SCHEMBL3384404

SCHEMBL3384404

CC1(c2nnc(NC(=O)Cc3ccc(-c4cnc5cc(-c6ccncc6)ccn45)cc3F)s2)CC1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDR P35968 13/20 0.42
FGFR3 P22607 11/20 0.42
FLT3 P36888 2/20 0.39
PRKACA P17612 1/20 0.36
ROCK1 Q13464 1/20 0.36
PIK3CA P42336 1/20 0.36
MTOR P42345 1/20 0.36

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
SCHEMBL3196061 0.86 KDR (0.46) KDRFGFR3FLT3
SCHEMBL13002537 0.86 KDR (0.34) KDRFGFR3
SCHEMBL3186881 0.85 FGFR3 (0.33) KDRFGFR3
SCHEMBL3186871 0.85 FGFR3 (0.33) KDRFGFR3
SCHEMBL3382858 0.85 GLS (0.44) KDRFGFR3
SCHEMBL3379579 0.84 KDR (0.43) KDRFGFR3FLT3PRKACAROCK1
SCHEMBL3177651 0.84 KDR (0.39) KDRFGFR3FLT3PIK3CAMTOR
SCHEMBL3380938 0.83 KDR (0.46) KDRFGFR3FLT3
SCHEMBL3196212 0.83 KDR (0.46) KDRFGFR3FLT3
SCHEMBL3385506 0.83 KDR (0.44) KDRFGFR3FLT3PIK3CAMTOR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101128461-B Imidazo (1, 2-a) pyridine compounds as VEGF-R2 inhibitors LILLY CO ELI 2010-12-22 CN disclosed
EP-1904494-B1 IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AS VEGF-R2 INHIBITORS LILLY CO ELI (US) 2010-12-01 EP disclosed
CN-101128461-A Imidazo (1, 2-a) pyridine compounds as VEGF-R2 inhibitors LILLY CO ELI (US) 2008-02-20 CN disclosed