SCHEMBL14214730

SCHEMBL14214730

COc1ccccc1Nc1nc2ccccc2n1-c1ncnc(Nc2cc(OC)c(OC)c(OC)c2)n1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 5/20 0.82
LCK P06239 3/20 0.82
MAPK14 Q16539 2/20 0.82
IGF1R P08069 3/20 0.56
PIK3CA P42336 5/20 0.55
MTOR P42345 5/20 0.55
NPC1 O15118 1/20 0.53
LMNA P02545 1/20 0.53
TP53 P04637 1/20 0.53
RAB9A P51151 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
PTK2 Q05397 5/20 0.51
FGFR1 P11362 1/20 0.49
FGFR2 P21802 1/20 0.49
FGFR4 P22455 1/20 0.49
FGFR3 P22607 1/20 0.49
PIK3CD O00329 2/20 0.47
PIK3CB P42338 2/20 0.47
PIK3CG P48736 2/20 0.47
RAF1 P04049 1/20 0.47

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
SCHEMBL6480335 0.88 LCK (0.71) KDRLCKMAPK14IGF1RPIK3CA
SCHEMBL14214609 0.87 KDR (0.87) KDRLCKMAPK14IGF1RPIK3CA
SCHEMBL14214615 0.87 KDR (0.85) KDRLCKMAPK14IGF1RPIK3CA
SCHEMBL14214616 0.86 KDR (0.84) KDRLCKMAPK14IGF1RPIK3CA
SCHEMBL14214612 0.85 KDR (0.82) KDRLCKMAPK14IGF1RPIK3CA
SCHEMBL14214680 0.85 LCK (0.76) KDRLCKMAPK14IGF1RPIK3CA
SCHEMBL6489956 0.84 KDR (0.81) KDRLCKMAPK14IGF1RPIK3CA
SCHEMBL14214614 0.84 KDR (0.78) KDRLCKMAPK14IGF1RPIK3CA
SCHEMBL6478952 0.84 KDR (0.74) KDRLCKMAPK14IGF1RPIK3CA
SCHEMBL6480028 0.82 KDR (0.77) KDRLCKMAPK14IGF1RPIK3CA

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-1218360-B1 TRIAZINE KINASE INHIBITORS AMGEN INC (US) 2008-05-28 EP disclosed