SCHEMBL7283041

SCHEMBL7283041

COC(CNc1ncc(-c2ccncc2)cc1C#N)OC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 2/20 0.39
PRKACA P17612 1/20 0.39
CDK8 P49336 1/20 0.39
CLK2 P49760 1/20 0.39
GSK3A P49840 1/20 0.39
GSK3B P49841 1/20 0.39
CDK9 P50750 1/20 0.39
CDK5 Q00535 1/20 0.39
PRKCQ Q04759 1/20 0.39
ROCK1 Q13464 1/20 0.39
DYRK1A Q13627 1/20 0.39
LRRK2 Q5S007 1/20 0.39
DYRK1B Q9Y463 1/20 0.39
AURKA O14965 1/20 0.37
TTK P33981 1/20 0.37
AURKB Q96GD4 1/20 0.37
INCENP Q9NQS7 1/20 0.37
CHEK1 O14757 1/20 0.37
GLA P06280 1/20 0.37
PIK3CA P42336 3/20 0.36

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
SCHEMBL7284179 0.84 GLA (0.42) CLK4PRKACACDK8CLK2GSK3A
SCHEMBL11238008 0.83 GSK3A (0.45) CLK4PRKACACDK8CLK2GSK3A
SCHEMBL7292117 0.81 ROCK1 (0.43) CLK4PRKACACDK8CLK2GSK3A
SCHEMBL11247724 0.77 PIK3CD (0.44) CLK4PRKACACDK8CLK2GSK3A
SCHEMBL7284439 0.77 PRKCH (0.46) CLK4PRKACACDK8CLK2GSK3A
SCHEMBL7291065 0.77 ROCK1 (0.46) CLK4PRKACACDK8CLK2GSK3A
SCHEMBL7282998 0.76 LATS1 (0.49) CLK4PRKACACDK8CLK2GSK3A
SCHEMBL7283889 0.75 LMNA (0.42) AAK1AXLMEN1KMT2AALDH1A1
SCHEMBL7293503 0.75 PRKCD (0.48) CLK4PRKACACDK8CLK2GSK3A
SCHEMBL27663061 0.75 CNR1 (0.57) LRRK2GLAALDH1A1NPSR1TDP1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0200024-B1 3-CYANO-PYRIDINES, PROCESS FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL USE ARZNEIMITTELWERK DRESDEN GmbH (DE) 1992-07-01 EP disclosed
EP-0200024-A2 3-Cyano-pyridines, process for their preparation and their pharmaceutical use ARZNEIMITTELWERK DRESDEN GmbH (DE) 1986-11-05 EP disclosed