SCHEMBL3263754

SCHEMBL3263754

COc1ccccc1CNC(=O)Oc1ccc(-c2cn[nH]c2)cc1

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 18/20 0.70
ROCK1 Q13464 12/20 0.59
HTT P42858 1/20 0.51

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
SCHEMBL3249896 0.86 ROCK2 (0.53) ROCK2ROCK1
SCHEMBL3243101 0.82 ROCK2 (1.00) ROCK2ROCK1HTT
SCHEMBL3248267 0.81 ROCK2 (0.66) ROCK2ROCK1
SCHEMBL8122573 0.80 POLB (0.63) HTT
SCHEMBL3246002 0.79 ROCK2 (0.72) ROCK2ROCK1
SCHEMBL3244603 0.77 ROCK2 (0.58) ROCK2ROCK1
SCHEMBL3234464 0.76 ROCK2 (0.70) ROCK2ROCK1
SCHEMBL1647884 0.74 ROCK2 (1.00) ROCK2ROCK1
SCHEMBL15968054 0.74 ROCK2 (1.00) ROCK2ROCK1
SCHEMBL1647894 0.74 ROCK2 (0.72) ROCK2ROCK1

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
WO-2010036316-A1 UREA AND CARBAMATE COMPOUNDS AND ANALOGS AS KINASE INHIBITORS FENG YANGBO (US) 2010-04-01 WO disclosed