SCHEMBL7658037

SCHEMBL7658037

CC(=O)NC1(C2CCCCC2)CCN(C(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)OC(C)(C)C)CC1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MC4R P32245 15/20 0.53
MC5R P33032 12/20 0.53
MC3R P41968 11/20 0.53
MC1R Q01726 11/20 0.53
CYP3A4 P08684 1/20 0.48
KMT2A Q03164 2/20 0.47
CACNA1B Q00975 1/20 0.45
MAPK1 P28482 1/20 0.44

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
SCHEMBL7658043 1.00 MC4R (0.53) MC4RMC5RMC3RMC1RCYP3A4
SCHEMBL6200842 0.85 MC4R (0.55) MC4RMC5RMC3RMC1RCYP3A4
SCHEMBL6200844 0.84 MC4R (0.58) MC4RMC5RMC3RMC1RCYP3A4
SCHEMBL1309435 0.83 MC4R (0.59) MC4RMC5RMC3RMC1RCYP3A4
SCHEMBL1309434 0.83 MC4R (0.59) MC4RMC5RMC3RMC1RCYP3A4
SCHEMBL6475531 0.81 MC4R (0.54) MC4RMC5RMC3RMC1RCYP3A4
SCHEMBL6215075 0.81 MC4R (0.51) MC4RMC5RMC3RMC1RCYP3A4
SCHEMBL6477067 0.81 MC4R (0.51) MC4RMC5RMC3RMC1RCYP3A4
SCHEMBL6181458 0.80 MC4R (0.51) MC4RMC5RMC3RMC1RCYP3A4
SCHEMBL6162303 0.80 KMT2A (0.58) MC4RCYP3A4KMT2ACACNA1BMAPK1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6350760-B1 OBESITY, DIABETES, SEXUAL DYSFUNCTION; MERCK & CO., INC. 2002-02-26 US disclosed