SCHEMBL13626907

SCHEMBL13626907

BCc1cnc2c(C#N)ccc(-c3c(Cl)c(OC)cc(OC)c3Cl)c2n1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 10/20 0.40
HPGDS O60760 1/20 0.37
PDE10A Q9Y233 1/20 0.36
FGFR4 P22455 1/20 0.34
CRHR1 P34998 2/20 0.34
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HPGD P15428 1/20 0.32
SRC P12931 2/20 0.32
NSD2 O96028 1/20 0.32

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
SCHEMBL13626908 0.96 FGFR3 (0.40) FGFR3HPGDSPDE10AFGFR4CRHR1
SCHEMBL1126531 0.89 FGFR3 (0.40) FGFR3HPGDSPDE10AFGFR4CRHR1
SCHEMBL3315714 0.85 HPGDS (0.40) FGFR3HPGDSFGFR4KDM4ESRC
SCHEMBL1126110 0.85 FGFR3 (0.40) FGFR3HPGDSPDE10AFGFR4KDM4E
SCHEMBL1126188 0.84 FGFR3 (0.38) FGFR3HPGDSFGFR4CRHR1KDM4E
SCHEMBL14212756 0.83 FGFR3 (0.36) FGFR3HPGDSPDE10AFGFR4CRHR1
SCHEMBL1126329 0.82 FGFR3 (0.59) FGFR3FGFR4SRC
SCHEMBL1126157 0.80 FGFR3 (0.38) FGFR3HPGDSFGFR4
SCHEMBL1126172 0.80 FGFR3 (0.38) FGFR3HPGDSFGFR4CRHR1
SCHEMBL1126250 0.80 FGFR3 (0.37) FGFR3HPGDSFGFR4

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