SCHEMBL3385176

SCHEMBL3385176

CC(C)c1ccc(NC(=O)NCc2ccc(-c3cnc4cc(-c5ccc(S(C)(=O)=O)cc5)ccn34)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 4/20 0.47
KDR P35968 4/20 0.46
FGFR3 P22607 3/20 0.46
FLT3 P36888 4/20 0.45
NPC1 O15118 1/20 0.44
RORC P51449 1/20 0.43
PRMT3 O60678 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
SCHEMBL3382113 0.94 KDR (0.50) NAMPTKDRFGFR3FLT3RORC
SCHEMBL3386178 0.92 NAMPT (0.47) NAMPTKDRFGFR3FLT3NPC1
SCHEMBL3385549 0.91 KDR (0.47) NAMPTKDRFGFR3FLT3RORC
SCHEMBL3380798 0.91 FLT3 (0.49) NAMPTKDRFGFR3FLT3NPC1
SCHEMBL3383915 0.88 NAMPT (0.49) NAMPTKDRFGFR3FLT3RORC
SCHEMBL3381951 0.88 FLT3 (0.58) NAMPTKDRFGFR3FLT3RORC
SCHEMBL3386534 0.88 FLT3 (0.53) NAMPTKDRFGFR3FLT3
SCHEMBL3383797 0.88 NAMPT (0.49) NAMPTKDRFGFR3FLT3
SCHEMBL3380684 0.88 EPHX2 (0.53) NAMPTKDRFGFR3FLT3
SCHEMBL3385494 0.87 KDR (0.45) NAMPTKDRFGFR3FLT3

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