SCHEMBL4739159

SCHEMBL4739159

NC(=O)N(c1ccc(-c2cccc3[nH]nc(N)c23)cc1)c1cc(CO)ccc1F

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 16/20 0.78
FLT3 P36888 12/20 0.61
FLT1 P17948 7/20 0.61
FLT4 P35916 7/20 0.61
CSF1R P07333 7/20 0.61
PRKACA P17612 6/20 0.61
ROCK1 Q13464 6/20 0.61
NTRK1 P04629 5/20 0.61
CDK5 Q00535 5/20 0.61
PLK4 O00444 5/20 0.61
AURKA O14965 5/20 0.61
ROCK2 O75116 5/20 0.61
CDK1 P06493 5/20 0.61
RPS6KB1 P23443 5/20 0.61
CSNK1D P48730 5/20 0.61
STK3 Q13188 5/20 0.61
MARK2 Q7KZI7 5/20 0.61
AURKB Q96GD4 5/20 0.61
FGFR1 P11362 4/20 0.61
DYRK1A Q13627 4/20 0.61

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
SCHEMBL27636556 0.94 KDR (0.77) KDRFLT3FLT1FLT4CSF1R
Acetic Acid SCHEMBL27785089 0.90 KDR (0.75) KDRFLT3FLT1FLT4CSF1R
Toluene SCHEMBL27811422 0.88 KDR (0.77) KDRFLT3FLT1FLT4CSF1R
SCHEMBL29923459 0.88 KDR (1.00) KDRFLT3FLT1FLT4CSF1R
SCHEMBL1426417 0.88 KDR (1.00) KDRFLT3FLT1FLT4CSF1R
Alcohol SCHEMBL16817143 0.87 KDR (0.94) KDRFLT3FLT1FLT4CSF1R
Water SCHEMBL15475146 0.87 KDR (0.98) KDRFLT3FLT1FLT4CSF1R
SCHEMBL4737713 0.86 KDR (0.77) KDRFLT3FLT1FLT4CSF1R
SCHEMBL4784148 0.86 KDR (0.77) KDRFLT3FLT1FLT4CSF1R
SCHEMBL27636400 0.83 KDR (0.62) KDRFLT3FLT1FLT4CSF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1826324-B indazole, Benzisoxazole and benzisothiazole kinase inhibitors ABBOTT LABORATORIES (US) 2011-12-07 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
WO-2008080110-A1 METHODS FOR TREATING MACULAR EDEMA AND PATHOLOGIC OCULAR ANGIOGENESIS USING A NEUROPROTECTIVE AGENT AND A RECEPTOR TYROSINE KINASE INHIBITOR ALCON, INC. (CH) 2008-07-03 WO disclosed
CN-1826324-A Indazole, benzisoxazole and benzisothiazole kinase inhibitors ABBOTT LAB (US) 2006-08-30 CN disclosed