SCHEMBL3385300

SCHEMBL3385300

CN(C)Cc1ccnc(NC(=O)Cc2ccc(-c3cnc4cc(-c5ccncc5)ccn34)cc2F)c1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDR P35968 10/20 0.44
FGFR3 P22607 9/20 0.44
PIK3CA P42336 1/20 0.40
MTOR P42345 1/20 0.40
WNT3A P56704 3/20 0.39
NEK2 P51955 1/20 0.38
NTRK1 P04629 1/20 0.37
FLT3 P36888 1/20 0.37

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
SCHEMBL3386120 0.90 KDR (0.46) KDRFGFR3WNT3ANTRK1FLT3
SCHEMBL3385600 0.86 KDR (0.46) KDRFGFR3PIK3CAMTORWNT3A
SCHEMBL3382504 0.86 KDR (0.47) KDRFGFR3PIK3CAMTORWNT3A
SCHEMBL3383524 0.85 KDR (0.43) KDRFGFR3PIK3CAMTORNEK2
SCHEMBL3385818 0.85 KDR (0.49) KDRFGFR3
SCHEMBL3382941 0.84 KDR (0.44) KDRFGFR3PIK3CAMTORWNT3A
SCHEMBL3383762 0.84 KDR (0.45) KDRFGFR3PIK3CAMTOR
SCHEMBL3384151 0.83 KDR (0.44) KDRFGFR3NTRK1FLT3
SCHEMBL3383110 0.80 RET (0.48) KDRFGFR3NTRK1FLT3
SCHEMBL3385381 0.80 KDR (0.42) KDRFGFR3PIK3CAMTORNEK2

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