SCHEMBL119372

SCHEMBL119372

O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.56
ACE P12821 3/20 0.55
FPR2 P25090 1/20 0.54
ITGB2 P05107 4/20 0.53
ICAM1 P05362 4/20 0.53
ITGAL P20701 4/20 0.53
NMBR P28336 2/20 0.52
MDM4 O15151 1/20 0.52
TP53 P04637 1/20 0.52
ECE1 P42892 2/20 0.52

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
SCHEMBL850319 1.00 ALOX15 (0.56) ALOX15ACEFPR2ITGB2ICAM1
SCHEMBL29350138 1.00 ALOX15 (0.56) ALOX15ACEFPR2ITGB2ICAM1
SCHEMBL29417397 1.00 ALOX15 (0.56) ALOX15ACEFPR2ITGB2ICAM1
SCHEMBL29350130 1.00 ALOX15 (0.56) ALOX15ACEFPR2ITGB2ICAM1
SCHEMBL119594 1.00 ALOX15 (0.56) ALOX15ACEFPR2ITGB2ICAM1
Water SCHEMBL6022940 0.99 ALOX15 (0.55) ALOX15ACEFPR2ITGB2ICAM1
Fluoride SCHEMBL7154596 0.99 ALOX15 (0.55) ALOX15ACEFPR2ITGB2ICAM1
SCHEMBL29903356 0.93 NMBR (0.55) ACENMBRECE1
SCHEMBL30310986 0.93 ACE (0.53) ACEECE1
SCHEMBL29903302 0.93 NMBR (0.55) ACENMBRECE1

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 156 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116075499-A Novel dephosphorylated galectin derivatives with prodrug properties 指南针探路者有限公司 2023-05-05 CN claimed
CN-110180022-B Shear force response supramolecular bionic articular cartilage material with dynamic lubrication self-repair capacity and preparation method thereof 吉林大学 2021-11-05 CN claimed
CN-112110834-A Modified hydrophobic auxiliary material and preparation method and application thereof 浙江智达药业有限公司 2020-12-22 CN claimed
CN-107670104-B Preparation method of self-lubricating bionic articular cartilage with shear force response 吉林大学 2020-07-03 CN claimed
EP-3429354-A1 B-VITAMIN AND AMINO ACID CONJUGATES OF NICOTINOYL RIBOSIDES AND REDUCED NICOTINOYL RIBOSIDES, DERIVATIVES THEREOF, AND METHODS OF PREPARATION THEREOF Chromadex Inc. (US) 2019-01-23 EP claimed
US-10000520-B2 B-vitamin and amino acid conjugates ofnicotinoyl ribosides and reduced nicotinoyl ribosides, derivatives thereof, and methods of preparation thereof ChromaDex Inc. (US) 2018-06-19 US claimed
US-20170267709-A1 B-VITAMIN AND AMINO ACID CONJUGATES OFNICOTINOYL RIBOSIDES AND REDUCED NICOTINOYL RIBOSIDES, DERIVATIVES THEREOF, AND METHODS OF PREPARATION THEREOF ChromaDex Inc. (US) 2017-09-21 US claimed
WO-2017161165-A1 B-VITAMIN AND AMINO ACID CONJUGATES OF NICOTINOYL RIBOSIDES AND REDUCED NICOTINOYL RIBOSIDES, DERIVATIVES THEREOF, AND METHODS OF PREPARATION THEREOF ChromaDex Inc. (US) 2017-09-21 WO claimed
CN-105585613-A Eptifibatide synthesis method HE RUNZE 2016-05-18 CN claimed
CN-102775471-B Method for synthesizing cholecystokinin octapeptide by combining solid phase method and liquid phase method GL BIOCHEM SHANGHAI CO LTD 2013-10-30 CN claimed
CN-102775471-A Method for synthesizing cholecystokinin octapeptide by combining solid phase method and liquid phase method GL BIOCHEM SHANGHAI CO LTD 2012-11-14 CN claimed
CN-100590068-C Method for preparing primary amine carbon nano tube UNIV TONGJI 2010-02-17 CN claimed
US-12415835-B2 Peptide-compound cyclization method CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-09-16 US disclosed
CN-120081948-A Co-assembly of self-assembled short peptide and recombinant III type collagen, and preparation method and application thereof 常州市智态生创科技有限公司 2025-06-03 CN disclosed
WO-2025043696-A1 ANTIVIRAL POLYPEPTIDE ANALOGUE 上海多米瑞生物技术有限公司 2025-03-06 WO disclosed
US-20240166689-A1 PEPTIDE-COMPOUND CYCLIZATION METHOD CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-05-23 US disclosed
WO-1998025949-A1 SUBSTITUTED 5-AMINO-1,3,4-THIADIAZOLE-2-THIONES PROSCRIPT, INC. (US) 1998-06-18 WO disclosed
EP-0845002-A2 AMINO ACID AMIDES OF 5-AMINO-1,3,4-THIADIAZONES AND THEIR USE AS INHIBITORS FOR MATRIX METALLOPROTEINASES PROSCRIPT, INC. (US) 1998-06-03 EP disclosed
US-5677282-A ENZYME INHIBITOR; OSTEOARTHRITIS AND RHEUMATIC DISORDERS PROSCRIPT, INC. (US) 1997-10-14 US disclosed
WO-1996040745-A2 AMINO ACID AMIDES OF 5-AMINO-1,3,4-THIADIAZONES AND THEIR USE AS INHIBITORS FOR MATRIX METALLOPROTEINASES PROSCRIPT, INC. (US) 1996-12-19 WO 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 (4 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-10000520-B2 B-vitamin and amino acid conjugates ofnicotinoyl ribosides and reduced nicotinoyl ribosides, derivatives thereof, and methods of preparation thereof NAMPT, NAPRT, NNMT ALOX15 2013/4885ACE 4681/4885FPR2 307/4885
US-20240166689-A1 PEPTIDE-COMPOUND CYCLIZATION METHOD VIP, NGLY1, GLP1R ALOX15 3621/4885ACE 621/4885FPR2 190/4885
US-20170267709-A1 B-VITAMIN AND AMINO ACID CONJUGATES OFNICOTINOYL RIBOSIDES AND REDUCED NICOTINOYL RIBOSIDES, DERIVATIVES THEREOF, AND METHODS OF PREPARATION THEREOF NAMPT, NAPRT, NNMT ALOX15 2013/4885ACE 4681/4885FPR2 307/4885
US-12415835-B2 Peptide-compound cyclization method VIP, NGLY1, GLP1R ALOX15 3621/4885ACE 621/4885FPR2 190/4885

“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.