SCHEMBL3383685

SCHEMBL3383685

CC(C)(C)c1csc(NC(=O)NCc2ccc(-c3cnc4cc(-c5ccncc5)ccn34)cc2)n1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.49
FGFR3 P22607 2/20 0.49
ROCK1 Q13464 15/20 0.49
ROCK2 O75116 12/20 0.49
SMN1; SMN2 Q16637 1/20 0.43
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43
TAS1R2 Q8TE23 1/20 0.43

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
SCHEMBL3385484 0.97 KDR (0.47) KDRFGFR3ROCK1ROCK2SMN1; SMN2
SCHEMBL3384408 0.86 KDR (0.50) KDRFGFR3
SCHEMBL3380736 0.86 KDR (0.50) KDRFGFR3
SCHEMBL3385883 0.84 KDR (0.50) KDRFGFR3
SCHEMBL3385035 0.84 KDR (0.49) KDRFGFR3
SCHEMBL3385811 0.84 KDR (0.49) KDRFGFR3
SCHEMBL3385534 0.81 KDR (0.50) KDRFGFR3
SCHEMBL3385831 0.81 KDR (0.48) KDRFGFR3ROCK1ROCK2
SCHEMBL3385490 0.80 FLT3 (0.43) KDRFGFR3
SCHEMBL3382607 0.78 FLT3 (0.46) KDRFGFR3ROCK1ROCK2

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