SCHEMBL28399679

SCHEMBL28399679

COc1cc2c(Oc3ccc(NC(=O)c4nn(-c5ccc(F)cc5)c(=O)n4C)cc3F)ccnc2cc1OCCCN1CCOCC1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 19/20 0.85
AXL P30530 3/20 0.73
FLT3 P36888 3/20 0.72
KIT P10721 2/20 0.72
PDGFRA P16234 2/20 0.72
KDR P35968 2/20 0.72
MST1R Q04912 2/20 0.72
PLK4 O00444 1/20 0.72
STK25 O00506 1/20 0.72
CIT O14578 1/20 0.72
AURKA O14965 1/20 0.72
CHUK O15111 1/20 0.72
MUSK O15146 1/20 0.72
EPHB6 O15197 1/20 0.72
MAPK13 O15264 1/20 0.72
MAP3K13 O43283 1/20 0.72
DAPK3 O43293 1/20 0.72
MAP3K7 O43318 1/20 0.72
RIPK2 O43353 1/20 0.72
JAK2 O60674 1/20 0.72

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
SCHEMBL28401426 0.95 MET (0.79) METFLT3KITPDGFRAKDR
SCHEMBL28408302 0.94 MET (0.90) METFLT3KITPDGFRAKDR
SCHEMBL28398179 0.94 MET (0.87) METFLT3KITPDGFRAKDR
SCHEMBL28407173 0.94 MET (0.91) METFLT3KITPDGFRAKDR
SCHEMBL15262332 0.93 MET (0.76) METAXLFLT3KITPDGFRA
SCHEMBL28403182 0.93 MET (0.88) METFLT3KITPDGFRAKDR
SCHEMBL28403285 0.93 MET (0.86) METAXLFLT3KITPDGFRA
SCHEMBL28403331 0.92 MET (1.00) METFLT3KITPDGFRAKDR
SCHEMBL28889594 0.91 MET (0.88) METFLT3KITPDGFRAKDR
SCHEMBL28411232 0.89 MET (1.00) METFLT3KITPDGFRAKDR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107474039-B 4-phenoxy substituted quinoline compound containing triazazolone and imidazole and application thereof 沈阳药科大学 2020-05-01 CN claimed
CN-107474039-B 4-phenoxy substituted quinoline compound containing triazazolone and imidazole and application thereof 沈阳药科大学 2020-05-01 CN disclosed