SCHEMBL8535132

SCHEMBL8535132

CN1C2CCC1CC(c1cccc(N)c1)C2

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 5/20 0.44
▸ OPRD1 P41143 5/20 0.44
▸ SLC6A2 P23975 3/20 0.43
▸ SLC6A3 Q01959 3/20 0.43
▸ SLC6A4 P31645 2/20 0.43
▸ OPRK1 P41145 1/20 0.42

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
SCHEMBL4669800 0.80 SLC18A3 (0.51) OPRM1OPRD1SLC6A2SLC6A3SLC6A4
SCHEMBL10295475 0.80 OPRM1 (0.64) OPRM1OPRD1
SCHEMBL12314083 0.80 OPRM1 (0.64) OPRM1OPRD1
SCHEMBL522190 0.79 SLC6A2 (0.43) SLC6A2SLC6A3SLC6A4
SCHEMBL29649871 0.79 SLC6A2 (0.43) SLC6A2SLC6A3SLC6A4
SCHEMBL1721954 0.78 SLC6A2 (0.55) OPRM1OPRD1SLC6A2SLC6A3SLC6A4
SCHEMBL633352 0.78 SLC6A2 (0.55) OPRM1OPRD1SLC6A2SLC6A3SLC6A4
SCHEMBL633351 0.78 SLC6A2 (0.55) OPRM1OPRD1SLC6A2SLC6A3SLC6A4
SCHEMBL12314095 0.76 DRD3 (0.58) —
SCHEMBL10295474 0.76 DRD3 (0.58) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0819126-A1 BIPHENYLAMIDE DERIVATIVES AS 5HT 1D? ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1998-01-21 — — EP disclosed
WO-1996031508-A1 BIPHENYLAMIDE DERIVATIVES AS 5HT1D ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1996-10-10 — — WO disclosed
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