SCHEMBL11463527

SCHEMBL11463527

NC(c1ccccc1)C1CCCN1C(c1ccccc1)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 20/20 0.68
OPRM1 P35372 19/20 0.68
OPRD1 P41143 19/20 0.68
OPRK1 P41145 19/20 0.68

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
SCHEMBL11471401 0.95 OPRL1 (0.67) OPRL1OPRM1OPRD1OPRK1
SCHEMBL11459988 0.90 OPRL1 (0.82) OPRL1OPRM1OPRD1OPRK1
SCHEMBL11461889 0.81 OPRL1 (1.00) OPRL1OPRM1OPRD1OPRK1
SCHEMBL9063100 0.81 OPRM1 (0.54) OPRL1OPRM1OPRD1OPRK1
SCHEMBL11467822 0.80 OPRM1 (0.46) OPRL1OPRM1OPRD1OPRK1
SCHEMBL3538856 0.78 CHRNB4 (0.55) OPRL1OPRM1OPRD1OPRK1
SCHEMBL31568823 0.78 CHRNB4 (0.55) OPRL1OPRM1OPRD1OPRK1
SCHEMBL3538855 0.78 CHRNB4 (0.55) OPRL1OPRM1OPRD1OPRK1
SCHEMBL5187982 0.78 CHRNB4 (0.55) OPRL1OPRM1OPRD1OPRK1
SCHEMBL13403254 0.78 CHRNB4 (0.55) OPRL1OPRM1OPRD1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4196124-A ANTIOBESITY AGENTS SCHERING CORPORATION (US) 1980-04-01 US disclosed
US-4173566-A CHEMICAL INTERMEDIATE FOR AN ANTIOBESITY AGENT SCHERING CORPORATION (US) 1979-11-06 US disclosed
US-4140780-A ANTIOBESITY AGENTS SCHERING CORPORATION (US) 1979-02-20 US disclosed
US-4052383-A ANTIOBESITY SCHERING CORPORATION (US) 1977-10-04 US disclosed