SCHEMBL187696

SCHEMBL187696

N=C(N)NCCC[C@H](NC(=O)CN)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
C3AR1 Q16581 1/20 0.45
GNPAT O15228 1/20 0.42
NOD1 Q9Y239 5/20 0.41
SLC15A2 Q16348 1/20 0.39
FOLH1 Q04609 2/20 0.39
EPHX2 P34913 2/20 0.38
SHMT1 P34896 1/20 0.38
NPY4R P50391 2/20 0.38
NPY1R P25929 1/20 0.38
NPY2R P49146 1/20 0.38
NPY5R Q15761 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.37
SLC6A5 Q9Y345 1/20 0.36
FNTA P49354 1/20 0.36
FNTB P49356 1/20 0.36
PGGT1B P53609 1/20 0.36

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
SCHEMBL29476474 1.00 C3AR1 (0.45) C3AR1GNPATNOD1SLC15A2FOLH1
SCHEMBL2116832 1.00 C3AR1 (0.45) C3AR1GNPATNOD1SLC15A2FOLH1
SCHEMBL4587702 0.98 C3AR1 (0.44) C3AR1GNPATNOD1SLC15A2FOLH1
SCHEMBL2815688 0.98 C3AR1 (0.44) C3AR1GNPATNOD1SLC15A2FOLH1
Benzene SCHEMBL6278673 0.97 C3AR1 (0.49) C3AR1GNPATNOD1SLC15A2FOLH1
SCHEMBL29875780 0.94 SLC15A2 (0.44) C3AR1GNPATNOD1SLC15A2NPY4R
SCHEMBL3952951 0.94 SLC15A2 (0.44) C3AR1GNPATNOD1SLC15A2NPY4R
SCHEMBL29875467 0.94 SLC15A2 (0.44) C3AR1GNPATNOD1SLC15A2NPY4R
SCHEMBL3952924 0.94 SLC15A2 (0.44) C3AR1GNPATNOD1SLC15A2NPY4R
SCHEMBL7764489 0.93 C3AR1 (0.41) C3AR1GNPATNOD1SLC15A2FOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117230048-A Threonine aldolase mutant with improved stereoselectivity and application thereof 浙江工业大学 2023-12-15 CN claimed
EP-3927354-A1 ENGINEERED ERYTHROID CELLS INCLUDING LOADABLE ANTIGEN-PRESENTING POLYPEPTIDES AND METHODS OF USE Rubius Therapeutics, Inc. (US) 2021-12-29 EP claimed
CN-113795263-A Engineered erythroid cells comprising loadable antigen-presenting polypeptides and methods of use 鲁比厄斯治疗法股份有限公司 2021-12-14 CN claimed
EP-2402037-B1 CONTROLLED RELEASE OF PHENOLIC OPIOIDS SIGNATURE THERAPEUTICS INC (US) 2019-10-23 EP claimed
US-20150291659-A1 SOLOMONAMIDE ANALOGUE COMPOUNDS, PHARMACEUTICALS CONTAINING SOLOMONAMIDE ANALOGUE COMPOUNDS, AND PROCESSES FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-10-15 US claimed
EP-2925771-A1 A PROCESS FOR THE PREPARATION OF SOLOMONAMIDE ANALOGUES Council of Scientific & Industrial Research (IN) 2015-10-07 EP claimed
US-20150148284-A1 Controlled Release of Phenolic Opioids PHARMACOFORE, INC. 2015-05-28 US claimed
US-9023860-B2 Pro-drugs for controlled release of biologically active compounds SIGNATURE THERAPEUTICS, INC. (US) 2015-05-05 US claimed
US-8921418-B2 Controlled release of phenolic opioids SIGNATURE THERAPEUTICS, INC. (US) 2014-12-30 US claimed
WO-2014083578-A1 A PROCESS FOR THE PREPARATION OF SOLOMONAMIDE ANALOGUES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESERACH AN INDIAN REGISTERED BODY INCORPORATED UNDER THE REGN. OF SOC. ACT (ACT XXI OF 1860) (IN) 2014-06-05 WO claimed
WO-2007140272-A2 CONTROLLED RELEASE OF PHENOLIC OPIOIDS PHARMACOFORE, INC. (US) 2007-12-06 WO claimed
WO-2006126188-A2 CXCR4 ANTAGONISTS FOR WOUND HEALING AND RE-EPITHELIALIZATION HADASIT MEDICAL RESEARCH SERVICES AND DEVELOPMENT LTD. (IL) 2006-11-30 WO claimed
US-20040116655-A1 Novel polypeptides and anti-hiv drugs containing the same BIOKINE THERAPEUTICS LTD. (IL) 2004-06-17 US claimed
EP-1323730-A1 NOVEL POLYPEPTIDES AND ANTI-HIV DRUGS CONTAINING THE SAME SEIKAGAKU CORPORATION (JP) 2003-07-02 EP claimed
EP-0677061-B1 POLYPEPTIDES AND ANTI-HIV AGENTS PREPARED THEREFROM SEIKAGAKU KOGYO CO LTD (JP) 1999-03-03 EP claimed
US-5776899-A Polypeptide and anti-HIV agent prepared therefrom SEIKAGAKU CORPORATION (JP) 1998-07-07 US claimed
CN-1038841-C Polypeptide and anti-hiv agent prepared therefrom SEIKAGAKU CO (JP) 1998-06-24 CN claimed
CN-1116427-A Novel polypeptide and anti-HIV agent prepared from the same SEIKAGAKU KOGYO CO LTD (JP) 1996-02-07 CN claimed
EP-0677061-A1 POLYPEPTIDE AND ANTI-HIV AGENT PREPARED THEREFROM SEIKAGAKU CORPORATION (JP) 1995-10-18 EP claimed
WO-1995010534-A1 POLYPEPTIDE AND ANTI-HIV AGENT PREPARED THEREFROM SEIKAGAKU CORPORATION (JP) 1995-04-20 WO claimed

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

For each of this compound's patents that has machine-readable text (2 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-20150148284-A1 Controlled Release of Phenolic Opioids OPRK1, OPRM1, OPRD1 C3AR1 1966/4885GNPAT 1897/4885NOD1 1272/4885
US-20150291659-A1 SOLOMONAMIDE ANALOGUE COMPOUNDS, PHARMACEUTICALS CONTAINING SOLOMONAMIDE ANALOGUE COMPOUNDS, AND PROCESSES FOR THE PREPARATION THEREOF CNR2, SRM, CNR1 C3AR1 327/4885GNPAT 1526/4885NOD1 269/4885

“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.