SCHEMBL21766638

SCHEMBL21766638

COCc1ccc(CN2C[C@]3(CC[C@](c4cccc(F)c4)(N(C)C)CC3)NC2=O)cc1

nearest known ligand 0.82

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 17/20 0.82
OPRM1 P35372 16/20 0.82

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
SCHEMBL19094089 0.90 OPRM1 (1.00) OPRL1OPRM1
SCHEMBL19104819 0.90 OPRM1 (1.00) OPRL1OPRM1
SCHEMBL19094091 0.90 OPRM1 (1.00) OPRL1OPRM1
SCHEMBL29460866 0.90 OPRM1 (1.00) OPRL1OPRM1
SCHEMBL20653754 0.82 OPRM1 (0.85) OPRL1OPRM1
SCHEMBL20640202 0.82 OPRM1 (0.85) OPRL1OPRM1
SCHEMBL20653752 0.82 OPRM1 (0.85) OPRL1OPRM1
SCHEMBL19093845 0.81 OPRM1 (0.84) OPRL1OPRM1
SCHEMBL19104863 0.81 OPRM1 (0.84) OPRL1OPRM1
SCHEMBL19093847 0.81 OPRM1 (0.84) OPRL1OPRM1

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-3402785-B1 3-(CARBOXYMETHYL)-8-AMINO-2-OXO-1,3-DIAZA-SPIRO-[4.5]-DECANE DERIVATIVES GRUENENTHAL GMBH (DE) 2020-02-26 EP disclosed