SCHEMBL6480028

SCHEMBL6480028

COC(=O)c1cccc(Nc2nc3ccccc3n2-c2ncnc(Nc3cc(OC)c(OC)c(OC)c3)n2)c1

nearest known ligand 0.77

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.77
LCK P06239 2/20 0.77
MAPK14 Q16539 2/20 0.77
PIK3CA P42336 9/20 0.58
MTOR P42345 9/20 0.58
PTK2 Q05397 5/20 0.57
PIK3CD O00329 3/20 0.50
PIK3CB P42338 3/20 0.50
PIK3CG P48736 3/20 0.50
RAF1 P04049 1/20 0.50
BRAF P15056 1/20 0.50
TGFBR2 P37173 1/20 0.50
CSNK1D P48730 1/20 0.50
SYK P43405 1/20 0.49
IGF1R P08069 2/20 0.47
TEK Q02763 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
SCHEMBL6478410 0.93 KDR (0.80) KDRLCKMAPK14PIK3CAMTOR
SCHEMBL6478730 0.93 KDR (0.77) KDRLCKMAPK14PIK3CAMTOR
SCHEMBL14214616 0.87 KDR (0.84) KDRLCKMAPK14PIK3CAMTOR
SCHEMBL14214680 0.84 LCK (0.76) KDRLCKMAPK14PIK3CAMTOR
SCHEMBL14214609 0.83 KDR (0.87) KDRLCKMAPK14PIK3CAMTOR
SCHEMBL14214615 0.82 KDR (0.85) KDRLCKMAPK14PIK3CAMTOR
SCHEMBL14214730 0.82 KDR (0.82) KDRLCKMAPK14PIK3CAMTOR
SCHEMBL6480335 0.81 LCK (0.71) KDRLCKMAPK14PIK3CAMTOR
SCHEMBL14214727 0.81 KDR (0.71) KDRLCKMAPK14PIK3CAMTOR
SCHEMBL14214612 0.81 KDR (0.82) KDRLCKMAPK14PIK3CAMTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6864255-B2 Substituted triazinyl amide derivatives and methods of use AMGEN INC. (US) 2005-03-08 US disclosed
EP-1385833-A1 TRIAZINYL AMIDE DERIVATIVES AS ANGIOGENESIS INHIBITORS Amgen Inc. (US) 2004-02-04 EP disclosed
WO-2002083654-A1 TRIAZINYL AMIDE DERIVATIVES AS ANGIOGENESIS INHIBITORS AMGEN INC. (US) 2002-10-24 WO disclosed