SCHEMBL11815689

SCHEMBL11815689

Cc1cc(O)c2c(c1)OC(C)(C)C1=C2CN(Cc2ccccc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 4/20 0.50
▸ CNR1 P21554 3/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ GAA P10253 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ DRD4 P21917 2/20 0.46
▸ DRD2 P14416 1/20 0.37
▸ DRD3 P35462 1/20 0.37
▸ ACHE P22303 1/20 0.37

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
SCHEMBL11716511 0.84 CNR2 (0.62) CNR2CNR1
SCHEMBL11819301 0.82 DRD4 (0.45) CNR2CNR1MEN1GAAKMT2A
SCHEMBL11627150 0.81 CNR2 (0.51) CNR2CNR1
SCHEMBL11322658 0.81 CNR2 (0.51) CNR2CNR1
SCHEMBL11322652 0.80 CNR2 (0.43) CNR2CNR1
SCHEMBL11630251 0.79 CNR2 (0.36) CNR2CNR1MEN1GAAKMT2A
SCHEMBL11630512 0.78 CNR2 (0.48) CNR2CNR1
SCHEMBL11717451 0.75 CNR2 (0.65) CNR2CNR1
SCHEMBL11738668 0.73 CNR2 (0.40) CNR2CNR1
SCHEMBL11816682 0.72 CNR2 (0.49) CNR2CNR1

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-3962448-A CNS DEPRESSANTS, VETERINARY SMITHKLINE CORPORATION (US) 1976-06-08 — — US disclosed
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