SCHEMBL14367013

SCHEMBL14367013

CC(C)(C)c1cc(-c2ccc(NC(=O)Nc3ccc(N)cc3)cc2)c2c(N)n[nH]c2n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 19/20 0.52
KIT P10721 17/20 0.52
FLT3 P36888 16/20 0.52
CSF1R P07333 7/20 0.48
FLT1 P17948 7/20 0.48
FLT4 P35916 7/20 0.48
LCK P06239 6/20 0.48
AURKA O14965 4/20 0.48
AURKB Q96GD4 4/20 0.48
CDK19 Q9BWU1 4/20 0.48
PLK4 O00444 3/20 0.48
ROCK2 O75116 3/20 0.48
INSR P06213 3/20 0.48
MET P08581 3/20 0.48
FGFR1 P11362 3/20 0.48
PRKACA P17612 3/20 0.48
RPS6KB1 P23443 3/20 0.48
CSNK1D P48730 3/20 0.48
STK3 Q13188 3/20 0.48
ROCK1 Q13464 3/20 0.48

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
SCHEMBL2817289 0.94 KDR (0.60) KDRKITFLT3CSF1RFLT1
SCHEMBL2816792 0.93 KDR (0.58) KDRKITFLT3CSF1RFLT1
SCHEMBL2819284 0.93 KDR (0.58) KDRKITFLT3CSF1RFLT1
SCHEMBL2822262 0.92 KDR (0.58) KDRKITFLT3CSF1RFLT1
SCHEMBL2821071 0.92 KDR (0.54) KDRKITFLT3CSF1RFLT1
SCHEMBL2816524 0.90 KDR (0.53) KDRKITFLT3CSF1RFLT1
SCHEMBL2818309 0.89 KDR (0.54) KDRKITFLT3CSF1RFLT1
SCHEMBL2816983 0.89 KDR (0.48) KDRKITFLT3CSF1RFLT1
SCHEMBL2817303 0.89 KIT (0.52) KDRKITFLT3CSF1RFLT1
SCHEMBL2819473 0.89 KDR (0.47) KDRKITFLT3CSF1RFLT1

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-2007144204-A1 SUBSTITUTED AMINOPYRAZOLOPYRIDINES AND SALTS THEREOF, THEIR PREPARATIONS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-12-21 WO disclosed