SCHEMBL3385668

SCHEMBL3385668

Cn1nc(C(C)(C)C)cc1NC(=O)Cc1ccc(-c2cnc3cc(-c4ccncc4)ccn23)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RET P07949 10/20 0.47
KDR P35968 3/20 0.47
MAPK14 Q16539 4/20 0.46
ERBB2 P04626 1/20 0.46
MAPK11 Q15759 1/20 0.46
FGFR3 P22607 1/20 0.46
AAK1 Q2M2I8 1/20 0.44
NTRK1 P04629 2/20 0.44
AURKA O14965 1/20 0.44
MAP4K4 O95819 1/20 0.44
CSF1R P07333 1/20 0.44
NTRK3 Q16288 1/20 0.44
NTRK2 Q16620 1/20 0.44
AURKB Q96GD4 1/20 0.44

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
SCHEMBL3385883 0.88 KDR (0.50) KDRMAPK14ERBB2MAPK11FGFR3
SCHEMBL3386449 0.87 RET (0.50) RETKDRMAPK14ERBB2MAPK11
SCHEMBL3382710 0.86 MAPK14 (0.60) RETKDRMAPK14ERBB2MAPK11
SCHEMBL3385352 0.82 WNT3A (0.49) RETKDRFGFR3
SCHEMBL3383188 0.82 FLT3 (0.48) RETKDRMAPK14FGFR3NTRK1
SCHEMBL3385380 0.81 KDR (0.47) KDRFGFR3
SCHEMBL3385345 0.81 RET (0.60) RETKDRMAPK14FGFR3NTRK1
SCHEMBL3385521 0.81 ALDH1A1 (0.55) KDRFGFR3
SCHEMBL3385509 0.80 WNT3A (0.49) RETKDRFGFR3
SCHEMBL3383429 0.78 FLT3 (0.48) RETKDRMAPK14ERBB2MAPK11

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