SCHEMBL9577755

SCHEMBL9577755

Fc1ccc(C2=CC3(CCCC3)Oc3ccccc32)cc1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 20/20 0.59
KCNH2 Q12809 16/20 0.59
OPRK1 P41145 6/20 0.59
CYP2D6 P10635 8/20 0.52
OPRM1 P35372 1/20 0.52

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
SCHEMBL1237576 0.87 OPRD1 (0.80) OPRD1KCNH2OPRK1CYP2D6OPRM1
Lithium Ion SCHEMBL7399401 0.86 OPRD1 (0.54) OPRD1KCNH2OPRK1CYP2D6OPRM1
Lithium Ion SCHEMBL4283263 0.78 OPRD1 (0.56) OPRD1KCNH2OPRK1CYP2D6OPRM1
SCHEMBL9845357 0.77 OPRD1 (0.45) OPRD1KCNH2OPRK1CYP2D6OPRM1
SCHEMBL1237845 0.77 OPRD1 (0.45) OPRD1KCNH2OPRK1CYP2D6OPRM1
SCHEMBL3696965 0.76 OPRD1 (0.54) OPRD1KCNH2OPRK1CYP2D6OPRM1
SCHEMBL19289109 0.75 OPRD1 (0.66) OPRD1KCNH2OPRK1CYP2D6OPRM1
SCHEMBL14666752 0.75 OPRD1 (0.42) OPRD1KCNH2OPRK1CYP2D6
SCHEMBL14666701 0.75 OPRD1 (0.40) OPRD1KCNH2OPRK1CYP2D6
SCHEMBL467151 0.75 OPRD1 (1.00) OPRD1KCNH2OPRK1CYP2D6OPRM1

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
US-5183924-A Anticholesterol agents, antithrombotics, fungicides LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1993-02-02 US disclosed
US-5082859-A Anticholesterol, anticoagulant, fungicide LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1992-01-21 US disclosed