SCHEMBL30503536

SCHEMBL30503536

CC1CC(C=O)(c2cccc(O)c2)C1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 8/20 0.43
OPRK1 P41145 8/20 0.43
OPRD1 P41143 4/20 0.43
SIGMAR1 Q99720 2/20 0.40

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
SCHEMBL25346330 0.81 CHRNA1 (0.40)
SCHEMBL31507286 0.81 CHRNA1 (0.40)
SCHEMBL9137028 0.74 ALOX5 (0.44) OPRM1OPRK1OPRD1SIGMAR1
SCHEMBL31206949 0.70 OPRM1 (0.61) OPRM1OPRK1OPRD1
SCHEMBL28937814 0.69 LIG1 (0.34)
SCHEMBL25838752 0.67 OPRD1 (0.41) OPRM1OPRK1OPRD1SIGMAR1
SCHEMBL28980719 0.65 OPRK1 (0.43) OPRM1OPRK1OPRD1
SCHEMBL30728165 0.65 ALDH1A1 (0.38)
SCHEMBL6447121 0.64 OPRD1 (0.73) OPRM1OPRK1OPRD1
Resorcinol SCHEMBL8974924 0.64 ALDH1A1 (0.67)

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
CN-116323557-A Cyclobutylamide monoacylglycerol lipase modulators 詹森药业有限公司 2023-06-23 CN disclosed