SCHEMBL27657289

SCHEMBL27657289

NCc1cccc(N(C(N)=O)c2ccc(-c3cccc4snc(N)c34)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDR P35968 9/20 0.47
FLT3 P36888 4/20 0.47
AURKA O14965 4/20 0.47
AURKB Q96GD4 4/20 0.47
ROCK2 O75116 1/20 0.47
CSF1R P07333 1/20 0.47
FGFR1 P11362 1/20 0.47
FLT1 P17948 1/20 0.47
RPS6KB1 P23443 1/20 0.47
FLT4 P35916 1/20 0.47
RPS6KA3 P51812 1/20 0.47
ROCK1 Q13464 1/20 0.47
PLK3 Q9H4B4 1/20 0.47
KIT P10721 3/20 0.44
CDK8 P49336 1/20 0.34
ABL1 P00519 1/20 0.31
BCR P11274 1/20 0.31
MAPK14 Q16539 1/20 0.31
TLR8 Q9NR97 1/20 0.30

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
SCHEMBL27657292 0.86 KDR (0.49) KDRFLT3AURKAAURKBROCK2
SCHEMBL27636392 0.85 KDR (0.51) KDRFLT3AURKAAURKBROCK2
SCHEMBL27657293 0.83 KDR (0.62) KDRFLT3AURKAAURKBROCK2
SCHEMBL28757593 0.80 KDR (0.53) KDRFLT3AURKBROCK2CSF1R
SCHEMBL27636462 0.80 KDR (0.60) KDRFLT3AURKAAURKBROCK2
SCHEMBL28760143 0.79 KDR (0.50) KDRFLT3AURKAAURKBROCK2
SCHEMBL27640577 0.75 EPHB4 (0.51) KDRFLT3AURKAAURKBROCK2
SCHEMBL27636410 0.75 KDR (0.45) KDRFLT3AURKAAURKBROCK2
SCHEMBL27657333 0.75 KDR (0.54) KDRFLT3AURKAAURKBROCK2
SCHEMBL27636389 0.75 KDR (0.49) KDRFLT3AURKAAURKBROCK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102417487-A Indazole, benzisoxazole and benzisothiazole kinase inhibitors ABBOTT LAB 2012-04-18 CN claimed
CN-1826324-A Indazole, benzisoxazole and benzisothiazole kinase inhibitors ABBOTT LAB (US) 2006-08-30 CN claimed
CN-102417487-A Indazole, benzisoxazole and benzisothiazole kinase inhibitors ABBOTT LAB 2012-04-18 CN disclosed
CN-1826324-B indazole, Benzisoxazole and benzisothiazole kinase inhibitors ABBOTT LABORATORIES (US) 2011-12-07 CN disclosed
CN-101827584-A Solid dispersion product of N-aryl ureido drugs ABBOTT GMBH & CO KG 2010-09-08 CN disclosed
CN-1826324-A Indazole, benzisoxazole and benzisothiazole kinase inhibitors ABBOTT LAB (US) 2006-08-30 CN disclosed