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SCHEMBL2153646

SCHEMBL2153646

CCCCOC1(c2ccccc2)CN(C(=O)[C@@H](Cc2ccc(Cl)cc2Cl)NC(=O)CCc2c[nH]cn2)C1.CCOC1(c2ccccc2C)CN(C(=O)[C@@H](Cc2ccc(OC)cc2)NC(=O)CCc2c[nH]cn2)C1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 14/20 0.63
▸ MC1R Q01726 9/20 0.63
▸ MC3R P41968 4/20 0.36
▸ MC5R P33032 1/20 0.36
▸ UGCG Q16739 4/20 0.35
▸ CYP3A4 P08684 3/20 0.35
▸ CYP51A1 Q16850 1/20 0.34

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
SCHEMBL2154655 0.94 MC4R (0.60) MC4RMC1RMC3RMC5RUGCG
SCHEMBL20450360 0.89 MC1R (0.78) MC4RMC1RMC3RMC5R
SCHEMBL1310201 0.89 MC1R (0.78) MC4RMC1RMC3RMC5R
SCHEMBL1310839 0.89 MC1R (0.78) MC4RMC1RMC3RMC5R
SCHEMBL1310089 0.88 MC4R (0.51) MC4RMC1RMC3RMC5RUGCG
SCHEMBL20450437 0.88 MC4R (0.51) MC4RMC1RMC3RMC5RUGCG
SCHEMBL20450370 0.88 MC1R (0.76) MC4RMC1RMC3RMC5R
SCHEMBL1310458 0.88 MC1R (0.76) MC4RMC1RMC3RMC5R
SCHEMBL20450415 0.87 MC1R (0.75) MC4RMC1RMC3RMC5R
SCHEMBL1310750 0.87 MC1R (0.75) MC4RMC1RMC3RMC5R

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
EP-2342194-A1 OXOAZETIDINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS Galderma Research & Development (FR) 2011-07-13 — — EP claimed