SCHEMBL3667057

SCHEMBL3667057

O=C(c1ccccc1)c1c(-c2ccc3[nH]ncc3c2)nnn1Cc1ccccc1.c1ccc(CCCc2cn(-c3ccc4[nH]ncc4c3)nn2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 13/20 0.67
GSK3B P49841 12/20 0.67
AURKB Q96GD4 9/20 0.67
JAK2 O60674 9/20 0.67
PRKACA P17612 8/20 0.57
CDK2 P24941 8/20 0.57
CDC7 O00311 8/20 0.57
AURKA O14965 7/20 0.57
CDK1 P06493 7/20 0.57
GSK3A P49840 7/20 0.57
CDK5 Q00535 7/20 0.57
PRKCD Q05655 7/20 0.57
PRKAA1 Q13131 7/20 0.57
ROCK1 Q13464 7/20 0.57
DYRK1A Q13627 7/20 0.57
CDC42BPA Q5VT25 7/20 0.57
RPS6KA3 P51812 6/20 0.57
MARK3 P27448 6/20 0.57
MAPK1 P28482 6/20 0.57
AKT1 P31749 5/20 0.57

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
SCHEMBL3667241 0.85 CDC7 (0.75) ROCK2GSK3BAURKBJAK2PRKACA
SCHEMBL3667957 0.82 ROCK2 (1.00) ROCK2GSK3BAURKBJAK2PRKACA
SCHEMBL3668436 0.79 CDC7 (0.72) ROCK2GSK3BAURKBJAK2PRKACA
SCHEMBL3667213 0.77 GSK3B (0.79) ROCK2GSK3BAURKBJAK2PRKACA
SCHEMBL3665013 0.76 JAK2 (1.00) ROCK2GSK3BAURKBJAK2PRKACA
SCHEMBL3666000 0.74 CDC7 (0.71) ROCK2GSK3BAURKBJAK2PRKACA
SCHEMBL3665661 0.73 GSK3B (1.00) ROCK2GSK3BAURKBJAK2PRKACA
SCHEMBL3673840 0.73 CDC7 (0.80) ROCK2GSK3BAURKBJAK2PRKACA
SCHEMBL3666406 0.72 ROCK2 (0.71) ROCK2GSK3BAURKBJAK2PRKACA
SCHEMBL3671481 0.72 ROCK2 (0.71) ROCK2GSK3BAURKBJAK2PRKACA

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-2167491-A1 5-HETEROARYL SUBSTITUTED INDAZOLES AS KINASE INHIBITORS Abbott Laboratories (US) 2010-03-31 EP claimed
WO-2008154241-A1 5-HETEROARYL SUBSTITUTED INDAZOLES AS KINASE INHIBITORS ABBOTT LABORATORIES (US) 2008-12-18 WO claimed