SCHEMBL13626423

SCHEMBL13626423

C=C/C=N\c1c(C(=O)Nc2ccc(CN(C)CCN(C)C)cn2)ccc(-c2cc(OC)cc(OC)c2F)c1N

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 11/20 0.49
F10 P00742 7/20 0.41
F2 P00734 1/20 0.36
NPC1 O15118 1/20 0.36
MITF O75030 1/20 0.36
TP53 P04637 1/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36
CHEK1 O14757 1/20 0.36

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
SCHEMBL1127101 0.81 FGFR3 (0.70) FGFR3F10
SCHEMBL17023036 0.74 FGFR3 (0.55) FGFR3F10CHEK1
SCHEMBL1126353 0.73 FGFR3 (0.81) FGFR3
SCHEMBL3317617 0.71 FGFR3 (0.50) FGFR3CHEK1
SCHEMBL1126391 0.70 FGFR3 (0.75) FGFR3
SCHEMBL3316242 0.69 FGFR3 (0.51) FGFR3
SCHEMBL14217248 0.67 FGFR3 (0.56) FGFR3
SCHEMBL12678322 0.67 FGFR3 (0.83) FGFR3
SCHEMBL1126624 0.66 FGFR3 (1.00) FGFR3
SCHEMBL12678327 0.66 FGFR3 (1.00) FGFR3

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-2009141386-A1 DERIVATIVES OF QUINOLINES AND QUINOXALINES AS PROTEIN TYROSINE KINASE INHIBITORS NOVARTIS AG (CH) 2009-11-26 WO disclosed