SCHEMBL71981

SCHEMBL71981

CC(C)(C)N1CC(C(=O)O)C(c2ccc(F)cc2F)C1

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MC4R P32245 17/20 0.64
MC3R P41968 7/20 0.62
MC5R P33032 7/20 0.62
MC1R Q01726 7/20 0.62
KCNH2 Q12809 4/20 0.62
PRCP P42785 2/20 0.56

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
SCHEMBL3170759 1.00 MC4R (0.64) MC4RMC3RMC5RMC1RKCNH2
SCHEMBL71984 1.00 MC4R (0.64) MC4RMC3RMC5RMC1RKCNH2
SCHEMBL29904550 1.00 MC4R (0.64) MC4RMC3RMC5RMC1RKCNH2
SCHEMBL15252713 1.00 MC4R (0.64) MC4RMC3RMC5RMC1RKCNH2
SCHEMBL91103 1.00 MC4R (0.64) MC4RMC3RMC5RMC1RKCNH2
SCHEMBL70497 1.00 MC4R (0.64) MC4RMC3RMC5RMC1RKCNH2
SCHEMBL30593923 1.00 MC4R (0.64) MC4RMC3RMC5RMC1RKCNH2
SCHEMBL1920391 1.00 MC4R (0.64) MC4RMC3RMC5RMC1RKCNH2
Hydrochloric Acid SCHEMBL4939210 0.99 MC4R (0.63) MC4RMC3RMC5RMC1RKCNH2
Hydrochloric Acid SCHEMBL4939214 0.99 MC4R (0.63) MC4RMC3RMC5RMC1RKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116888110-A Melanocortin-4 receptor agonists 株式会社LG 化学 2023-10-13 CN disclosed
US-8569299-B2 Prolylcarboxypeptidase inhibitors MERCK SHARP & DOHME CORP (US) 2013-10-29 US disclosed
EP-2350060-B1 MELANOCORTIN RECEPTOR AGONISTS LG LIFE SCIENCES LTD (KR) 2013-09-18 EP disclosed
US-20130143859-A1 NOVEL PROLYLCARBOXYPEPTIDASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2013-06-06 US disclosed
EP-2579716-A1 NOVEL PROLYLCARBOXYPEPTIDASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2013-04-17 EP disclosed
US-8129413-B2 Crystalline forms of MC4R agonist and process for synthesis MERCK SHARP & DOHME CORP. (US) 2012-03-06 US disclosed
US-8129413-B2 Crystalline forms of MC4R agonist and process for synthesis MERCK SHARP & DOHME CORP. (US) 2012-03-06 US disclosed
WO-2011156220-A1 NOVEL PROLYLCARBOXYPEPTIDASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-12-15 WO disclosed
EP-1610789-B1 BICYCLIC PIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR AGONISTS MERCK SHARP & DOHME (US) 2010-07-21 EP disclosed
US-7649002-B2 (3,5-dimethylpiperidin-1yl)(4-phenylpyrrolidin-3-yl)methanone derivatives as MCR4 agonists PFIZER INC (US) 2010-01-19 US disclosed
EP-1648457-A2 PIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR AGONISTS Merck & Co., Inc. (US) 2006-04-26 EP disclosed
WO-2006020277-A2 ACYLATED PIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR AGONISTS MERCK & CO., INC. (US) 2006-02-23 WO disclosed
EP-1613601-A2 ACYLATED SPIROPIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR AGONISTS Merck & Co. Inc. (US) 2006-01-11 EP disclosed
EP-1383501-A4 ACYLATED PIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR AGONISTS MERCK & CO INC (US) 2005-10-12 EP disclosed
WO-2005077935-A1 PIPERIDINYLCARBONYL-PYRROLIDINES AND THEIR USE AS MELANOCORTIN AGONISTS PFIZER LIMITED (GB) 2005-08-25 WO disclosed
US-20050176772-A1 Pharmaceutically active compounds PFIZER INC 2005-08-11 US disclosed
WO-2005009950-A2 PIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR AGONISTS MERCK & CO., INC. (US) 2005-02-03 WO disclosed
WO-2004089307-A2 ACYLATED SPIROPIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR AGONISTS MERCK & CO. INC. (US) 2004-10-21 WO disclosed
EP-1383501-A2 ACYLATED PIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR AGONISTS Merck & Co., Inc. (US) 2004-01-28 EP disclosed
WO-2002068388-A2 ACYLATED PIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR AGONISTS MERCK & CO., INC. (US) 2002-09-06 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 (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-20050176772-A1 Pharmaceutically active compounds MC4R, MC3R, MC5R MC4R 1/4885MC3R 2/4885MC5R 3/4885
US-20130143859-A1 NOVEL PROLYLCARBOXYPEPTIDASE INHIBITORS PREP, PRCP, DPEP1 MC4R 1101/4885MC3R 2867/4885MC5R 2167/4885

“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.