SCHEMBL11783971

SCHEMBL11783971

C#CCN1CCC2(CC1)OC(c1ccc(CC)cc1)c1ccccc12

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 4/20 0.48
▸ SIGMAR1 Q99720 5/20 0.46
▸ ADRA2A P08913 1/20 0.43
▸ OPRD1 P41143 2/20 0.42
▸ OPRM1 P35372 1/20 0.42
▸ OPRK1 P41145 1/20 0.42
▸ KCNH2 Q12809 1/20 0.41

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
SCHEMBL11781464 0.89 OPRD1 (0.45) PRCPSIGMAR1ADRA2AOPRD1KCNH2
SCHEMBL11781143 0.89 SIGMAR1 (0.51) PRCPSIGMAR1ADRA2AOPRD1OPRM1
SCHEMBL11781772 0.87 PRCP (0.52) PRCPSIGMAR1OPRD1OPRM1OPRK1
SCHEMBL11780509 0.87 SIGMAR1 (0.45) PRCPSIGMAR1OPRD1OPRM1OPRK1
SCHEMBL11778772 0.84 OPRD1 (0.47) PRCPSIGMAR1ADRA2AOPRD1OPRM1
SCHEMBL11778403 0.82 OPRD1 (0.47) PRCPSIGMAR1ADRA2AOPRD1OPRM1
SCHEMBL11782375 0.81 PRCP (0.43) PRCPSIGMAR1ADRA2AOPRD1KCNH2
SCHEMBL11856002 0.80 PRCP (0.46) PRCPSIGMAR1ADRA2A
SCHEMBL11858736 0.78 OPRD1 (0.54) PRCPSIGMAR1ADRA2AOPRD1OPRM1
SCHEMBL11780816 0.76 OPRD1 (0.41) PRCPSIGMAR1OPRD1OPRM1OPRK1

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-3980786-A 1,3-Dihydro-3-phenyl-1'-(2-propynyl)spiro[isobenzofuran]s AMERICAN HOECHST CORPORATION (US) 1976-09-14 — — US disclosed
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