SCHEMBL3383229

SCHEMBL3383229

CC(C)(C)c1cc(NC(=O)Nc2ccc(-c3cnc4cc(-c5ccncc5F)ccn34)cc2F)no1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
FLT3 P36888 9/20 0.51
MAPK14 Q16539 4/20 0.46
MAPK13 O15264 1/20 0.46
RET P07949 3/20 0.45
MAPT P10636 2/20 0.42
HTT P42858 2/20 0.42
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.42
RAF1 P04049 1/20 0.41
ATM Q13315 1/20 0.41

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
SCHEMBL3381118 0.91 NPC1 (0.54) NPC1RAB9AFLT3MAPK14MAPK13
SCHEMBL3381854 0.86 NPC1 (0.49) NPC1RAB9AFLT3MAPK14MAPK13
SCHEMBL3384166 0.86 RAB9A (0.52) NPC1RAB9AFLT3MAPK14MAPK13
SCHEMBL3198885 0.86 NPC1 (0.53) NPC1RAB9AFLT3MAPK14MAPK13
SCHEMBL3385839 0.85 NPC1 (0.51) NPC1RAB9AFLT3MAPK14MAPK13
SCHEMBL3383068 0.85 NPC1 (0.50) NPC1RAB9AFLT3MAPK14MAPK13
SCHEMBL3383303 0.84 NPC1 (0.52) NPC1RAB9AFLT3MAPK14MAPK13
SCHEMBL3385155 0.84 NPC1 (0.49) NPC1RAB9AFLT3MAPK14MAPK13
SCHEMBL3381837 0.83 NPC1 (0.48) NPC1RAB9AFLT3MAPK14MAPK13
SCHEMBL13002517 0.82 FLT3 (0.48) NPC1RAB9AFLT3MAPK14MAPK13

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