SCHEMBL21554760

SCHEMBL21554760

COc1cc(Nc2ccc3ncc(-c4cnc(OC)nc4)nc3c2)cc(OC)c1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 15/20 0.69
KDR P35968 15/20 0.69
FGFR1 P11362 13/20 0.43
FGFR2 P21802 13/20 0.43
FGFR4 P22455 13/20 0.43
FLT3 P36888 4/20 0.43
CSF1R P07333 2/20 0.43
KIT P10721 1/20 0.42
APP P05067 1/20 0.41
PDGFRB P09619 1/20 0.41
PDGFRA P16234 1/20 0.41
YES1 P07947 1/20 0.41

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
SCHEMBL19749646 0.86 FGFR3 (0.66) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL21554939 0.85 FGFR3 (0.65) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL12178203 0.83 FGFR3 (0.76) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL16421990 0.82 FGFR3 (0.65) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL12178236 0.81 FGFR3 (1.00) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL29870618 0.81 FGFR3 (1.00) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL19749883 0.78 FGFR3 (0.74) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL22122109 0.78 KDR (0.59) FGFR3KDRCSF1RKITPDGFRB
SCHEMBL14788087 0.78 KDR (0.59) FGFR3KDRFGFR1CSF1RKIT
SCHEMBL28634926 0.78 KDR (0.59) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2776408-B1 ANTICANCER BENZOPYRAZINES VIA THE INHIBITION OF FGFR KINASES ASTEX THERAPEUTICS LTD (GB) 2019-11-06 EP disclosed