SCHEMBL2463508

SCHEMBL2463508

Nc1nccn2c(C3CCCCC3)nc(-c3cccc(OCc4ccccc4)c3)c12.O=C(O)NCCN1CCCC1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 20/20 0.76
ROCK2 O75116 1/20 0.69
PRKD3 O94806 1/20 0.69
INSR P06213 1/20 0.69
LYN P07948 1/20 0.69
RET P07949 1/20 0.69
FGFR1 P11362 1/20 0.69
RPS6KB1 P23443 1/20 0.69
FLT4 P35916 1/20 0.69
FLT3 P36888 1/20 0.69
FRK P42685 1/20 0.69
STK3 Q13188 1/20 0.69
ROCK1 Q13464 1/20 0.69
PTK6 Q13882 1/20 0.69
ERBB4 Q15303 1/20 0.69
NTRK3 Q16288 1/20 0.69
AURKB Q96GD4 1/20 0.69
PRKD2 Q9BZL6 1/20 0.69
MKNK2 Q9HBH9 1/20 0.69
MAP4K5 Q9Y4K4 1/20 0.69

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
SCHEMBL2463378 0.91 IGF1R (0.81) IGF1RTNK2
SCHEMBL2457735 0.91 IGF1R (0.80) IGF1RROCK2PRKD3INSRLYN
SCHEMBL2463556 0.91 IGF1R (0.79) IGF1RTNK2
SCHEMBL2460665 0.90 IGF1R (0.78) IGF1RTNK2
SCHEMBL2466131 0.90 IGF1R (0.78) IGF1RTNK2
SCHEMBL2464417 0.90 IGF1R (0.83) IGF1RTNK2
SCHEMBL2464840 0.89 IGF1R (0.77) IGF1RTNK2
SCHEMBL2460158 0.89 IGF1R (0.77) IGF1RTNK2
SCHEMBL2460384 0.89 IGF1R (0.82) IGF1RTNK2
Bicarbonate SCHEMBL2464578 0.89 IGF1R (0.93) IGF1R

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
EP-1675860-B1 IMIDAZO[1,5-A]PYRAZINES AS TYROSINE KINASE INHIBITORS OSI PHARM INC (US) 2011-09-21 EP claimed