SCHEMBL7828176

SCHEMBL7828176

CCc1c(C2(c3cccc(O)c3)CCCN(CC3CC3)C2)ccc(C(N)=O)c1C

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 11/20 0.56
OPRD1 P41143 9/20 0.56
OPRM1 P35372 8/20 0.56

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
SCHEMBL27551809 0.80 OPRD1 (0.43) OPRK1OPRD1OPRM1
SCHEMBL27551779 0.78 OPRD1 (0.45) OPRK1OPRD1OPRM1
SCHEMBL6598934 0.75 OPRK1 (0.77) OPRK1OPRD1OPRM1
SCHEMBL27551806 0.74 OPRD1 (0.62) OPRK1OPRD1OPRM1
SCHEMBL6601891 0.72 OPRD1 (1.00) OPRK1OPRD1OPRM1
SCHEMBL6601046 0.72 OPRD1 (0.84) OPRK1OPRD1OPRM1
SCHEMBL6598957 0.71 OPRD1 (1.00) OPRK1OPRD1OPRM1
SCHEMBL6601922 0.71 OPRD1 (0.81) OPRK1OPRD1OPRM1
SCHEMBL6598465 0.70 OPRD1 (0.70) OPRK1OPRD1OPRM1
SCHEMBL7827245 0.70 OPRM1 (0.39) OPRK1OPRD1OPRM1

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-1140835-A1 3,3-BIARYLPIPERIDINE AND 2,2-BIARYLMORPHOLINE DERIVATIVES Pfizer Products Inc. (US) 2001-10-10 EP disclosed
WO-2000039091-A1 3,3-BIARYLPIPERIDINE AND 2,2-BIARYLMORPHOLINE DERIVATIVES PFIZER PRODUCTS INC. (US) 2000-07-06 WO disclosed