SCHEMBL713213

SCHEMBL713213

N[C@@H](Cc1cnc[nH]1)C(=O)OCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.62
▸ CYP3A4 P08684 1/20 0.61
▸ SLC7A5 Q01650 1/20 0.61
▸ NLN Q9BYT8 1/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13061496 1.00 LTA4H (0.62) LTA4HCYP3A4SLC7A5NLN
Hydrochloric Acid SCHEMBL27320108 0.99 LTA4H (0.61) LTA4HCYP3A4SLC7A5
SCHEMBL6816189 0.90 LTA4H (0.58) LTA4HCYP3A4SLC7A5NLN
SCHEMBL3626018 0.87 CYP3A4 (0.58) LTA4HCYP3A4SLC7A5NLN
SCHEMBL1007042 0.87 CYP3A4 (0.61) LTA4HCYP3A4SLC7A5NLN
SCHEMBL21001107 0.84 CYP3A4 (0.51) LTA4HCYP3A4SLC7A5NLN
SCHEMBL28231837 0.84 CYP3A4 (0.57) LTA4HCYP3A4SLC7A5NLN
SCHEMBL11416854 0.83 CYP3A4 (0.50) LTA4HCYP3A4SLC7A5NLN
SCHEMBL6114085 0.83 CYP3A4 (0.62) LTA4HCYP3A4SLC7A5NLN
Phenylalanine SCHEMBL28074950 0.82 SLC7A5 (0.80) LTA4HCYP3A4SLC7A5NLN

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 103 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115209912-A Peptide compositions and methods of use thereof 杜兰教育基金管理者 2022-10-18 — — CN claimed
CN-107556438-B Multi-responsive cross-linked polymer, drug-loaded nano micelle and preparation method thereof 西南民族大学 2020-05-12 — — CN claimed
US-9598288-B2 Method for preparing zinc-histidine self-assembly biomimetric complex, zinc-histidine self-assembly complex prepared by said method, and method for reducing carbon dioxide using said zinc-histidine self-assembly complex INDUSTRY-ACADEMIC COOPERATION FOUNDATION YONSEI UNIVERSITY (KR) 2017-03-21 — — US claimed
US-20150151974-A1 METHOD FOR PREPARING ZINC-HISTIDINE SELF-ASSEMBLY BIOMIMETRIC COMPLEX, ZINC-HISTIDINE SELF-ASSEMBLY COMPLEX PREPARED BY SAID METHOD, AND METHOD FOR REDUCING CARBON DIOXIDE USING SAID ZINC-HISTIDINE SELF-ASSEMBLY COMPLEX INDUSTRY-ACADEMIC COOPERATION FOUNDATION YONSEI UNIVERSITY (KR) 2015-06-04 — — US claimed
CN-102241674-B Synthesis method and antitumor activity evaluation of 1,1-dimethyl-beta-carboline-3-formacyl amino acid benzyl ester UNIV CAPITAL MEDICAL 2012-09-12 — — CN claimed
CN-101906102-B Beta-carboline alkaloid derivative, preparation method and application thereof UNIV CAPITAL MEDICAL 2012-08-29 — — CN claimed
US-8124128-B2 Amphiphilic block copolymers and nano particles comprising the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2012-02-28 — — US claimed
CN-102250202-A 1-paranitrophenyl-beta-carboline-3-formyl amine acid carbamates and synthesis method and use thereof UNIV CAPITAL MEDICAL 2011-11-23 — — CN claimed
CN-102241674-A Synthesis method and antitumor activity evaluation of 1,1-dimethyl-beta-carboline-3-formacyl amino acid benzyl ester UNIV CAPITAL MEDICAL 2011-11-16 — — CN claimed
CN-101597288-B 2-aminoacyl-Beta-3-formyol tryptophan benzyl ester and preparation method and application thereof UNIV BEIJING 2011-08-17 — — CN claimed
CN-101497615-B Substituted purine, preparation and use in medicine ZHEJIANG MED XINCHANG PHARM 2010-12-15 — — CN claimed
CN-101906102-A Beta-carboline alkaloid derivative, preparation method and application thereof UNIV CAPITAL MEDICAL 2010-12-08 — — CN claimed
CN-101597290-A β-Ka Lin-3-formyl tryptophyl amino-acid benzyl ester and its production and application UNIV CAPITAL MEDICAL (CN) 2009-12-09 — — CN claimed
CN-101597288-A 2-aminoacyl-β-Ka Lin-3-formyl tryptophan benzyl ester and its production and application UNIV BEIJING (CN) 2009-12-09 — — CN claimed
CN-101497615-A Substituted purine, preparation and use in medicine XINCHANG PHARMACEUTICAL FACTORY ZHEJIANG MEDICINE CO LTD (CN) 2009-08-05 — — CN claimed
EP-0565646-A4 — — 1994-08-03 — — EP claimed
EP-0565646-A1 NUCLEOSIDES AND OLIGONUCLEOSIDES WITH A PHOSPHATE-FREE INTERNUCLEOSIDE BACKBONE AND PROCESS FOR PREPARING THE SAME BAYLOR COLLEGE OF MEDICINE (US) 1993-10-20 — — EP claimed
WO-1992018518-A1 NUCLEOSIDES AND OLIGONUCLEOSIDES WITH A PHOSPHATE-FREE INTERNUCLEOSIDE BACKBONE AND PROCESS FOR PREPARING THE SAME BAYLOR COLLEGE OF MEDICINE (US) 1992-10-29 — — WO claimed
US-4960881-A REACTING AMINO ACID WITH ALPHA-CHLORINATED CARBONATE IN SOLVENT IN PRESENCE OF ACID SCAVENGER SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1990-10-02 — — US claimed
JP-1026596-A — — None — — JP disclosed
WO-2023230236-A1 PROCESS FOR PREPARING JAK INHIBITORS AND INTERMEDIATES THEREOF THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-11-30 — — WO disclosed
CN-115209912-A Peptide compositions and methods of use thereof 杜兰教育基金管理者 2022-10-18 — — CN disclosed
CN-114786709-A IL-2 chimeric proteins for immunosuppression 国家生物技术研究所公司 2022-07-22 — — CN disclosed
CN-107556438-B Multi-responsive cross-linked polymer, drug-loaded nano micelle and preparation method thereof 西南民族大学 2020-05-12 — — CN disclosed
EP-3387012-A1 VARIANTS OF AMYLOID BETA-PROTEIN PRECURSOR INHIBITOR DOMAIN The National Institute for Biotechnology in the Negev Ltd. (IL) 2018-10-17 — — EP disclosed
CN-107556438-A Multiple response sexual intercourse linked polymer and medicament-carried nano micelle and their preparation method 西南民族大学 2018-01-09 — — CN disclosed
WO-2017098516-A1 VARIANTS OF AMYLOID beta-PROTEIN PRECURSOR INHIBITOR DOMAIN The National Institute for Biotechnology in the Negev Ltd. (IL) 2017-06-15 — — WO disclosed
US-9598288-B2 Method for preparing zinc-histidine self-assembly biomimetric complex, zinc-histidine self-assembly complex prepared by said method, and method for reducing carbon dioxide using said zinc-histidine self-assembly complex INDUSTRY-ACADEMIC COOPERATION FOUNDATION YONSEI UNIVERSITY (KR) 2017-03-21 — — US disclosed
US-20150151974-A1 METHOD FOR PREPARING ZINC-HISTIDINE SELF-ASSEMBLY BIOMIMETRIC COMPLEX, ZINC-HISTIDINE SELF-ASSEMBLY COMPLEX PREPARED BY SAID METHOD, AND METHOD FOR REDUCING CARBON DIOXIDE USING SAID ZINC-HISTIDINE SELF-ASSEMBLY COMPLEX INDUSTRY-ACADEMIC COOPERATION FOUNDATION YONSEI UNIVERSITY (KR) 2015-06-04 — — US disclosed
US-8940333-B2 Amphiphilic block copolymers and nanoparticles comprising the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2015-01-27 — — US disclosed
CN-102250202-B 1-paranitrophenyl-beta-carboline-3-formyl amine acid carbamates and synthesis method and use thereof UNIV CAPITAL MEDICAL SCIENCES 2013-08-28 — — CN disclosed
CN-102241674-B Synthesis method and antitumor activity evaluation of 1,1-dimethyl-beta-carboline-3-formacyl amino acid benzyl ester UNIV CAPITAL MEDICAL 2012-09-12 — — CN disclosed
CN-101906102-B Beta-carboline alkaloid derivative, preparation method and application thereof UNIV CAPITAL MEDICAL 2012-08-29 — — CN disclosed
US-8138370-B2 Method of producing optically active α-amino acid benzyl esters SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-03-20 — — US disclosed
US-8124128-B2 Amphiphilic block copolymers and nano particles comprising the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2012-02-28 — — US disclosed
WO-2011153588-A1 VIRAL POLYMERASE INHIBITORS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2011-12-15 — — WO disclosed
CN-102250202-A 1-paranitrophenyl-beta-carboline-3-formyl amine acid carbamates and synthesis method and use thereof UNIV CAPITAL MEDICAL 2011-11-23 — — CN disclosed
CN-102241674-A Synthesis method and antitumor activity evaluation of 1,1-dimethyl-beta-carboline-3-formacyl amino acid benzyl ester UNIV CAPITAL MEDICAL 2011-11-16 — — CN disclosed
CN-101597290-B Beta-carboline-3-formyl tryptophyl amine acid carbamate as well as preparation method and application thereof UNIV CAPITAL MEDICAL 2011-11-09 — — CN disclosed
CN-102164953-A Nitrogen responsive early nodulin gene UNIV GUELPH 2011-08-24 — — CN disclosed
CN-101597288-B 2-aminoacyl-Beta-3-formyol tryptophan benzyl ester and preparation method and application thereof UNIV BEIJING 2011-08-17 — — CN disclosed
US-20100324131-A1 Salvinorin Derivatives and Uses Thereof NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2010-12-23 — — US disclosed
CN-101497615-B Substituted purine, preparation and use in medicine ZHEJIANG MED XINCHANG PHARM 2010-12-15 — — CN disclosed
CN-101906102-A Beta-carboline alkaloid derivative, preparation method and application thereof UNIV CAPITAL MEDICAL 2010-12-08 — — CN disclosed
US-20100203150-A1 Novel amphiphilic copolymers and fabrication method thereof NATIONAL TSING HUA UNIVERSITY (TW) 2010-08-12 — — US disclosed
CN-1922324-B Bacterial virulence factors and uses thereof UNIV BRITISH COLUMBIA 2010-06-09 — — CN disclosed
CN-101711861-A bacterial virulence factors and uses thereof UNIV BRITISH COLUMBIA 2010-05-26 — — CN disclosed
US-20100010254-A1 METHOD OF PRODUCING OPTICALLY ACTIVE ALPHA-AMINO ACID BENZYL ESTERS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-01-14 — — US disclosed
CN-101597290-A β-Ka Lin-3-formyl tryptophyl amino-acid benzyl ester and its production and application UNIV CAPITAL MEDICAL (CN) 2009-12-09 — — CN disclosed
CN-101597290-A β-Ka Lin-3-formyl tryptophyl amino-acid benzyl ester and its production and application UNIV CAPITAL MEDICAL (CN) 2009-12-09 — — CN disclosed
CN-101597288-A 2-aminoacyl-β-Ka Lin-3-formyl tryptophan benzyl ester and its production and application UNIV BEIJING (CN) 2009-12-09 — — CN disclosed
CN-101511776-A Process for production of optically active alpha-amino acid benzyl ester SUMITOMO CHEMICAL CO (JP) 2009-08-19 — — CN disclosed
CN-101497615-A Substituted purine, preparation and use in medicine XINCHANG PHARMACEUTICAL FACTORY ZHEJIANG MEDICINE CO LTD (CN) 2009-08-05 — — CN disclosed
EP-2062873-A1 PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE ALPHA-AMINO ACID BENZYL ESTER Sumitomo Chemical Company, Limited (JP) 2009-05-27 — — EP disclosed
US-20080166382-A1 AMPHIPHILIC BLOCK COPOLYMERS AND NANOPARTICLES COMPRISING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE 2008-07-10 — — US disclosed
US-20070104654-A1 Amphiphilic block copolymers and nano particles comprising the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE 2007-05-10 — — US disclosed
CN-1922324-A Bacterial virulence factors and uses thereof UNIV BRITISH COLUMBIA (CA) 2007-02-28 — — CN disclosed
US-7045532-B2 ACE-2 modulating compounds and methods of use thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2006-05-16 — — US disclosed
US-20050176017-A1 Immobilized nucleic acid enzymes for use in medical and environmental diagnostics YALE UNIVERSITY (US) 2005-08-11 — — US disclosed
US-20040082496-A1 ACE-2 modulating compounds and methods of use thereof MILLENNIUM PHARMACEUTICALS, INC. 2004-04-29 — — US disclosed
EP-0958303-A4 BIOREACTIVE ALLOSTERIC POLYNUCLEOTIDES UNIV YALE (US) 2004-03-31 — — EP disclosed
CN-1455680-A MUCl extracellular domain and cancer treatment compositions and methods derived therefrom DANA PHARBO CANCER ASS LTD (US) 2003-11-12 — — CN disclosed
US-6632830-B1 Blood pressure related disease or disorder, cell proliferation disorder, kidney disorder, kinetensin associated disorder, inflammation associated disorder, or an allergic disorder MILLENNIUM PHARMACEUTICALS, INC. 2003-10-14 — — US disclosed
US-6630306-B1 DNA comprising a enzyme domain; interaction of a chemical effector (metal ion or small molecule) with DNA alters its cleavage function or configuration; use as biosensors YALE UNIVERSITY 2003-10-07 — — US disclosed
CN-1420926-A Anti-angiogenic proteins and fragments and methods of use thereof BETH ISRAEL HOSPITAL (US) 2003-05-28 — — CN disclosed
CN-1377259-A ACE-2 inhibiting compounds and methods of use thereof MILLENNIUM PHARM INC (US) 2002-10-30 — — CN disclosed
WO-2000066104-A9 ACE-2 INHIBITING COMPOUNDS AND METHODS OF USE THEREOF MILLENNIUM PHARM INC (US) 2002-08-29 — — WO disclosed
WO-2002039997-A2 ACE-2 MODULATING COMPOUNDS AND USE THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2002-05-23 — — WO disclosed
EP-1183019-A2 ACE-2 INHIBITING COMPOUNDS AND METHODS OF USE THEREOF Millennium Pharmaceuticals, Inc. (US) 2002-03-06 — — EP disclosed
EP-1135398-A1 CYANOPHOSPHONAMIDES AND METHOD FOR PREPARATION Monsanto Technology LLC (US) 2001-09-26 — — EP disclosed
US-6218563-B1 Cyanophosphonamides and method for preparation MONSANTO COMPANY 2001-04-17 — — US disclosed
WO-2000066104-A2 ACE-2 INHIBITING COMPOUNDS AND METHODS OF USE THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2000-11-09 — — WO disclosed
WO-2000032611-A1 CYANOPHOSPHONAMIDES AND METHOD FOR PREPARATION MONSANTO TECHNOLOGY LLC (US) 2000-06-08 — — WO disclosed
EP-0958303-A1 BIOREACTIVE ALLOSTERIC POLYNUCLEOTIDES Yale University (US) 1999-11-24 — — EP disclosed
EP-0948502-A1 CYANOPHOSPHORUS COMPOUNDS AND THEIR PREPARATION MONSANTO COMPANY (US) 1999-10-13 — — EP disclosed
EP-0948506-A1 CYANOPHOSPHONATE DERIVATIVES MONSANTO COMPANY (US) 1999-10-13 — — EP disclosed
US-5945082-A HERBICIDES, INSECTICIDES, FLAME RETARDANTS, PLASTICIZERS; CYANATION, SALT FORMATION, PHOSPHONATION, PHOSPHATING MONSANTO COMPANY (US) 1999-08-31 — — US disclosed
US-5935542-A Cyanphosphonate derivatives and method for their preparation MONSANTO COMPANY (US) 1999-08-10 — — US disclosed
WO-1998029419-A1 CYANOPHOSPHORUS COMPOUNDS AND THEIR PREPARATION MONSANTO COMPANY (US) 1998-07-09 — — WO disclosed
WO-1998029422-A1 CYANOPHOSPHONATE DERIVATIVES MONSANTO COMPANY (US) 1998-07-09 — — WO disclosed
WO-1998027104-A1 BIOREACTIVE ALLOSTERIC POLYNUCLEOTIDES YALE UNIVERSITY (US) 1998-06-25 — — WO disclosed
WO-1996023490-A9 FORMULATIONS AND METHODS FOR REDUCING SKIN IRRITATION — 1996-12-27 — — WO disclosed
CN-1109780-A Sustained-release preparation of anti-endothelin substance TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1995-10-11 — — CN disclosed
EP-0565646-A4 — — 1994-08-03 — — EP disclosed
EP-0297816-B1 Homocyclostatine and cyclostatine containing polypeptides as antihypertensive agents PFIZER (US) 1994-03-02 — — EP disclosed
EP-0266950-B1 Nor-statine and nor-cyclostatine polypeptides PFIZER (US) 1993-12-29 — — EP disclosed
EP-0565646-A1 NUCLEOSIDES AND OLIGONUCLEOSIDES WITH A PHOSPHATE-FREE INTERNUCLEOSIDE BACKBONE AND PROCESS FOR PREPARING THE SAME BAYLOR COLLEGE OF MEDICINE (US) 1993-10-20 — — EP disclosed
US-5175266-A Oxidizing hydroxymethyl function of azidodeoxynucleosides to acid in presence of ruthenium tetroxide TRIPLEX PHARMACEUTICAL CORPORATION (US) 1992-12-29 — — US disclosed
WO-1992018518-A1 NUCLEOSIDES AND OLIGONUCLEOSIDES WITH A PHOSPHATE-FREE INTERNUCLEOSIDE BACKBONE AND PROCESS FOR PREPARING THE SAME BAYLOR COLLEGE OF MEDICINE (US) 1992-10-29 — — WO disclosed
US-5110799-A Inhibition of viral ribonucleotide reductase MERCK & CO., INC. (US) 1992-05-05 — — US disclosed
US-5034376-A Nor-statine and nor-cyclostatine polypeptides PFIZER INC. (US) 1991-07-23 — — US disclosed
EP-0412595-A1 Antiherpetic agents MERCK & CO. INC. (US) 1991-02-13 — — EP disclosed
US-4960881-A REACTING AMINO ACID WITH ALPHA-CHLORINATED CARBONATE IN SOLVENT IN PRESENCE OF ACID SCAVENGER SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1990-10-02 — — US disclosed
US-4935405-A Nor-statine and nor-cyclostatine polypeptides PFIZER INC. (US) 1990-06-19 — — US disclosed
WO-1989010751-A1 FUNCTIONALIZED PEPTIDYL AMINODIOLS AND -TRIOLS ABBOTT LABORATORIES (US) 1989-11-16 — — WO disclosed
EP-0341602-A2 Renin-inhibiting functionalized peptidyl aminodiols and - triols ABBOTT LABORATORIES (US) 1989-11-15 — — EP disclosed
US-4859654-A Homocyclostatine and cyclostatine containing polypeptides as antihypertensive agents PFIZER INC. (US) 1989-08-22 — — US disclosed
EP-0307837-A2 Renin-inhibiting peptidyl heterocycles ABBOTT LABORATORIES (US) 1989-03-22 — — EP disclosed
US-4814342-A Nor-statine and nor-cyclostatine polypeptides PFIZER INC. (US) 1989-03-21 — — US disclosed
EP-0297816-A2 Homocyclostatine and cyclostatine containing polypeptides as antihypertensive agents PFIZER INC. (US) 1989-01-04 — — EP disclosed
EP-0266950-A2 Nor-statine and nor-cyclostatine polypeptides PFIZER INC. (US) 1988-05-11 — — EP disclosed
US-4665056-A CENTRAL NERVOUS SYSTEM DISORDERS TANABE SEIYAKU CO., LTD. (JP) 1987-05-12 — — US disclosed
EP-0168042-A2 Dihydroorotic acid derivatives, processes for their preparing and pharmaceutical composition containing them TANABE SEIYAKU CO., LTD. (JP) 1986-01-15 — — EP disclosed
EP-0168042-A2 Dihydroorotic acid derivatives, processes for their preparing and pharmaceutical composition containing them TANABE SEIYAKU CO., LTD. (JP) 1986-01-15 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100324131-A1 Salvinorin Derivatives and Uses Thereof OPRK1, OPRD1, OPRM1 LTA4H 3671/4885CYP3A4 1293/4885SLC7A5 1581/4885
US-20080166382-A1 AMPHIPHILIC BLOCK COPOLYMERS AND NANOPARTICLES COMPRISING THE SAME EGFR, ABHD16A, TSG101 LTA4H 2568/4885CYP3A4 4402/4885SLC7A5 513/4885
US-20040082496-A1 ACE-2 modulating compounds and methods of use thereof ACE, ACE2, AGTR2 LTA4H 1191/4885CYP3A4 1491/4885SLC7A5 3222/4885
US-20070104654-A1 Amphiphilic block copolymers and nano particles comprising the same MITF, EGFR, LNPEP LTA4H 3123/4885CYP3A4 3778/4885SLC7A5 186/4885
US-20050176017-A1 Immobilized nucleic acid enzymes for use in medical and environmental diagnostics RNGTT, ADA, DNTT LTA4H 2225/4885CYP3A4 941/4885SLC7A5 4282/4885
US-20100010254-A1 METHOD OF PRODUCING OPTICALLY ACTIVE ALPHA-AMINO ACID BENZYL ESTERS BCAT1, BCAT2, AADAT LTA4H 1643/4885CYP3A4 992/4885SLC7A5 571/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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