SCHEMBL3385345

SCHEMBL3385345

CC(C)(C)c1cc(NC(=O)Cc2ccc(-c3cnc4cc(-c5ccncc5)ccn34)cc2)no1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RET P07949 10/20 0.60
NTRK1 P04629 3/20 0.51
KDR P35968 3/20 0.51
CSF1R P07333 1/20 0.51
KCNH2 Q12809 1/20 0.51
CCDC6 Q16204 1/20 0.51
ROCK1 Q13464 1/20 0.47
WNT3A P56704 2/20 0.46
FGFR3 P22607 1/20 0.46
RAF1 P04049 1/20 0.45
KIT P10721 1/20 0.45
FLT3 P36888 1/20 0.44
MAPK13 O15264 1/20 0.43
MAPK14 Q16539 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
SCHEMBL3383547 0.91 RET (0.56) RETNTRK1KDRCSF1RKCNH2
SCHEMBL3386505 0.89 RET (0.65) RETNTRK1KDRCSF1RKCNH2
SCHEMBL3385534 0.88 KDR (0.50) RETKDRFGFR3RAF1FLT3
SCHEMBL3383110 0.88 RET (0.48) RETNTRK1KDRCSF1RKCNH2
SCHEMBL3383013 0.88 RET (0.48) RETNTRK1KDRCSF1RKCNH2
SCHEMBL3176763 0.87 RET (0.53) RETNTRK1KDRCSF1RKCNH2
SCHEMBL3188885 0.87 RET (0.58) RETNTRK1KDRCSF1RKCNH2
SCHEMBL3386414 0.86 RAF1 (0.58) RETKDRCSF1RFGFR3RAF1
SCHEMBL3186841 0.86 RET (0.53) RETNTRK1KDRCSF1RKCNH2
SCHEMBL3385352 0.85 WNT3A (0.49) RETKDRWNT3AFGFR3

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