SCHEMBL1126337

SCHEMBL1126337

CN(C)CCOc1ccc(N)cc1.O=C(Nc1ncc[nH]1)c1ccc(-c2ccccc2F)c2nccnc12

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 10/20 0.42
HDAC1 Q13547 1/20 0.36
ADORA2A P29274 2/20 0.35
ADORA1 P30542 2/20 0.35
HRH3 Q9Y5N1 1/20 0.35
IMPDH2 P12268 1/20 0.34
PTGES O14684 1/20 0.34
KDR P35968 1/20 0.34
CACNA1H O95180 1/20 0.33

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
SCHEMBL3346457 0.92 FGFR3 (0.38) FGFR3HDAC1ADORA2AADORA1IMPDH2
SCHEMBL12678257 0.84 HRH3 (0.46) FGFR3HRH3KDR
SCHEMBL3352671 0.84 FGFR3 (0.44) FGFR3ADORA2AADORA1HRH3PTGES
SCHEMBL1127069 0.83 FGFR3 (0.49) FGFR3PTGESKDR
SCHEMBL1126571 0.83 FGFR3 (0.42) FGFR3PTGES
SCHEMBL3346853 0.83 FGFR3 (0.48) FGFR3HDAC1ADORA2AADORA1
SCHEMBL3348914 0.76 FGFR3 (0.42) FGFR3PTGES
SCHEMBL17023135 0.73 FAAH (0.53) HRH3
SCHEMBL1126140 0.71 HRH3 (0.53) FGFR3HRH3KDR
SCHEMBL17023080 0.70 HSP90AA1 (0.38) 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
EP-2282995-A1 DERIVATIVES OF QUINOLINES AND QUINOXALINES AS PROTEIN TYROSINE KINASE INHIBITORS Novartis AG (CH) 2011-02-16 EP claimed