SCHEMBL3384060

SCHEMBL3384060

CC(C)(C)OC(=O)NCc1ccc(-c2cnc3cc(-c4ccncc4)ccn23)cc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDR P35968 9/20 0.52
FGFR3 P22607 3/20 0.49
FLT3 P36888 6/20 0.46
PIK3CA P42336 1/20 0.45
MTOR P42345 1/20 0.45
CLK1 P49759 1/20 0.44
CYP17A1 P05093 1/20 0.43
NAMPT P43490 1/20 0.43
HDAC1 Q13547 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
SCHEMBL3176784 0.87 KDR (0.47) KDRFGFR3FLT3
SCHEMBL3183935 0.87 KDR (0.40) KDRFGFR3FLT3NAMPTHDAC1
SCHEMBL3188717 0.85 KDR (0.47) KDRFGFR3FLT3NAMPTHDAC1
SCHEMBL3190565 0.83 KDR (0.48) KDRFGFR3HDAC1
SCHEMBL3197804 0.82 KDR (0.55) KDRFGFR3
SCHEMBL506891 0.81 CYP17A1 (0.61) CYP17A1NAMPTHDAC1
SCHEMBL3384408 0.79 KDR (0.50) KDRFGFR3FLT3
SCHEMBL3380736 0.79 KDR (0.50) KDRFGFR3FLT3
SCHEMBL3385883 0.79 KDR (0.50) KDRFGFR3
SCHEMBL3385534 0.79 KDR (0.50) KDRFGFR3FLT3

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