SCHEMBL763034

SCHEMBL763034

CCc1c(C(=O)C(C)(C)C)nc(-c2ccccc2Cl)n1-c1ccc(Cl)cc1

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 14/20 0.64
CNR2 P34972 7/20 0.60
ACHE P22303 2/20 0.49

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
SCHEMBL738485 0.87 CNR1 (0.68) CNR1CNR2ACHE
SCHEMBL764490 0.86 CNR1 (0.70) CNR1CNR2ACHE
SCHEMBL739526 0.84 CNR1 (0.64) CNR1CNR2ACHE
SCHEMBL6333070 0.80 CNR1 (0.59) CNR1CNR2ACHE
SCHEMBL6337279 0.79 CNR1 (0.64) CNR1CNR2ACHE
SCHEMBL6342015 0.79 CNR1 (0.66) CNR1CNR2ACHE
SCHEMBL762432 0.79 CNR1 (1.00) CNR1CNR2
SCHEMBL28779646 0.77 CNR1 (0.68) CNR1CNR2ACHE
SCHEMBL6335075 0.77 CNR1 (0.66) CNR1CNR2ACHE
SCHEMBL763028 0.77 CNR1 (0.55) CNR1CNR2ACHE

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-8138174-B2 Such as N-{1-[7-(2-amino-ethoxyimino)-7-[4-(trifluoromethyl)phenyl]heptylamino]-1-[3-(4-chlorophenyl)-4-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-methylidene)-4-chloro-benzenesulfonamide; pain. psychosis, anxiety, depression, attention deficits, cognitive disorders, obesity; neurodegenerative disorders SOLVAY PHARMACEUTICALS B.V. (NL) 2012-03-20 US disclosed