SCHEMBL3680985

SCHEMBL3680985

Cn1cc(-c2cnc3ccc(-c4cncn4C)cc3n2)cn1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 15/20 0.62
KDR P35968 15/20 0.62
FGFR1 P11362 12/20 0.50
FGFR2 P21802 12/20 0.50
FGFR4 P22455 12/20 0.50
FLT3 P36888 4/20 0.50
TTK P33981 3/20 0.48
MAPK1 P28482 1/20 0.47
GSK3B P49841 1/20 0.47
DYRK1A Q13627 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
SCHEMBL16257036 0.78 FGFR3 (0.72) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL3079717 0.77 FGFR3 (0.60) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL2591038 0.77 FGFR3 (0.71) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL29834960 0.77 FGFR3 (0.71) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL12178582 0.77 FGFR3 (0.71) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL12178238 0.77 FGFR3 (0.71) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL3688517 0.77 FGFR3 (0.63) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL3685812 0.75 FGFR3 (0.55) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL3678302 0.75 FGFR3 (0.60) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL24289863 0.74 FGFR3 (0.67) FGFR3KDRFGFR1FGFR2FGFR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2173354-A1 QUINOXALINE DERIVATIVES AS PI3 KINASE INHIBITORS GlaxoSmithKline LLC (US) 2010-04-14 EP disclosed
WO-2009021083-A1 QUINOXALINE DERIVATIVES AS PI3 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-02-12 WO disclosed