SCHEMBL3383112

SCHEMBL3383112

CC(C)(C)c1cc(NC(=O)Cc2ccc(-c3cnc4cc(-c5ccc(S(C)(=O)=O)cc5)ccn34)cc2F)no1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RET P07949 4/20 0.53
CSF1R P07333 2/20 0.53
KDR P35968 2/20 0.53
KCNH2 Q12809 2/20 0.53
NTRK1 P04629 1/20 0.53
CCDC6 Q16204 1/20 0.53
FLT3 P36888 8/20 0.46
KIT P10721 6/20 0.44
AURKA O14965 1/20 0.44
MAP4K4 O95819 1/20 0.44
EGFR P00533 1/20 0.44
AURKB Q96GD4 1/20 0.44
FGFR3 P22607 1/20 0.40

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
SCHEMBL3385282 0.91 KDR (0.45) RETCSF1RKDRKCNH2NTRK1
SCHEMBL3383110 0.90 RET (0.48) RETCSF1RKDRKCNH2NTRK1
SCHEMBL3386505 0.88 RET (0.65) RETCSF1RKDRKCNH2NTRK1
SCHEMBL3383303 0.86 NPC1 (0.52) RETCSF1RKDRKCNH2NTRK1
SCHEMBL3189878 0.85 KDR (0.49) RETKDRFLT3KITFGFR3
SCHEMBL3381104 0.84 KDR (0.55) RETCSF1RKDRKCNH2NTRK1
SCHEMBL3385275 0.82 KDR (0.51) RETCSF1RKDRKCNH2NTRK1
SCHEMBL3383492 0.82 FLT3 (0.50) RETCSF1RKDRKCNH2NTRK1
SCHEMBL3383912 0.81 KDR (0.51) KDRFGFR3
SCHEMBL3383013 0.81 RET (0.48) RETCSF1RKDRKCNH2NTRK1

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