SCHEMBL11537945

SCHEMBL11537945

Fc1cccc(C23CCCCC2CN(CCc2ccccc2)CC3)c1

nearest known ligand 0.77

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 12/20 0.53
OPRK1 P41145 12/20 0.53
OPRD1 P41143 11/20 0.53
SLC6A3 Q01959 2/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 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
SCHEMBL11537943 1.00 OPRM1 (0.53) OPRM1OPRK1OPRD1SLC6A3SLC6A2
SCHEMBL11533931 0.89 SLC6A2 (0.56) OPRM1OPRK1OPRD1SLC6A3SLC6A2
SCHEMBL11533934 0.89 SLC6A2 (0.56) OPRM1OPRK1OPRD1SLC6A3SLC6A2
SCHEMBL11193094 0.87 OPRM1 (0.70) OPRM1OPRK1OPRD1
SCHEMBL11533477 0.87 OPRM1 (0.70) OPRM1OPRK1OPRD1
SCHEMBL11193098 0.87 OPRM1 (0.70) OPRM1OPRK1OPRD1
SCHEMBL11536050 0.85 SLC6A4 (0.61) OPRM1OPRK1OPRD1SLC6A3SLC6A2
SCHEMBL11194100 0.85 SLC6A4 (0.61) OPRM1OPRK1OPRD1SLC6A3SLC6A2
SCHEMBL11194103 0.85 SLC6A4 (0.61) OPRM1OPRK1OPRD1SLC6A3SLC6A2
SCHEMBL11260608 0.85 OPRM1 (0.50) OPRM1OPRK1OPRD1SLC6A3SLC6A2

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-4150135-A ANALGESICS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1979-04-17 US disclosed