SCHEMBL3385688

SCHEMBL3385688

CC(C)(C)c1cc(N(OS(C)(=O)=O)C(=O)Nc2ccc(-c3cnc4cc(-c5cccnc5)ccn34)cc2)no1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 2/20 0.46
MTOR P42345 2/20 0.46
KDR P35968 10/20 0.44
FGFR3 P22607 7/20 0.44
FLT3 P36888 3/20 0.42
GABRG2 P18507 1/20 0.39
GABRB3 P28472 1/20 0.39
GABRA3 P34903 1/20 0.39
NTRK1 P04629 1/20 0.36
PORCN Q9H237 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
RAF1 P04049 1/20 0.35

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
SCHEMBL3381856 0.90 PIK3CA (0.45) PIK3CAMTORKDRFGFR3FLT3
SCHEMBL3385682 0.83 FLT3 (0.54) PIK3CAMTORKDRFGFR3FLT3
SCHEMBL3385159 0.79 FGFR3 (0.34) PIK3CAMTORKDRFGFR3FLT3
SCHEMBL3383424 0.75 FLT3 (0.45) PIK3CAMTORKDRFGFR3FLT3
SCHEMBL3381854 0.74 NPC1 (0.49) PIK3CAMTORKDRFGFR3FLT3
SCHEMBL3385641 0.72 FLT3 (0.45) PIK3CAMTORKDRFGFR3FLT3
SCHEMBL3386414 0.72 RAF1 (0.58) KDRFGFR3FLT3RAF1
SCHEMBL3383492 0.72 FLT3 (0.50) KDRFLT3NTRK1RAF1
SCHEMBL3385308 0.71 KDR (0.41) PIK3CAMTORKDRFGFR3RAF1
SCHEMBL3385510 0.71 MAPK14 (0.48) KDRFLT3RAF1

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-1904494-B1 IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AS VEGF-R2 INHIBITORS LILLY CO ELI (US) 2010-12-01 EP disclosed