SCHEMBL5824203

SCHEMBL5824203

CCN(CC)C(=O)c1cc(C(=O)F)ccc1C(=C1CCN(Cc2ccccc2)CC1)c1ccccc1N(C)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 17/20 0.49
OPRM1 P35372 16/20 0.49
KCNH2 Q12809 8/20 0.46
OPRK1 P41145 4/20 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
SCHEMBL1603121 0.80 OPRD1 (0.62) OPRD1OPRM1KCNH2OPRK1
SCHEMBL1603304 0.78 OPRD1 (0.60) OPRD1OPRM1KCNH2OPRK1
SCHEMBL1603518 0.74 OPRD1 (0.59) OPRD1OPRM1KCNH2OPRK1
SCHEMBL1603161 0.74 OPRD1 (0.74) OPRD1OPRM1KCNH2OPRK1
SCHEMBL4932328 0.73 OPRD1 (0.73) OPRD1OPRM1KCNH2OPRK1
SCHEMBL1603684 0.71 OPRD1 (0.61) OPRD1OPRM1KCNH2OPRK1
SCHEMBL6610713 0.71 OPRD1 (0.71) OPRD1OPRM1KCNH2OPRK1
SCHEMBL4923000 0.71 OPRD1 (0.65) OPRD1OPRM1KCNH2OPRK1
SCHEMBL5727063 0.70 OPRD1 (0.69) OPRD1OPRM1KCNH2OPRK1
SCHEMBL5370140 0.70 OPRD1 (0.69) OPRD1OPRM1KCNH2OPRK1

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-1641757-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES, PREPARATIONS THEREOF AND USES THEREOF AstraZeneca AB (SE) 2006-04-05 EP disclosed
WO-2004101522-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES, PREPARATIONS THEREOF AND USES THEREOF ASTRAZENECA AB (SE) 2004-11-25 WO disclosed