SCHEMBL29693456

SCHEMBL29693456

COc1cc2c(Oc3ccc(NC(=O)C4(C(=O)Nc5ccc(F)cc5)[C@H](C)[C@H]4C)cc3F)ccnc2cc1OCCCN1CCOCC1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 16/20 0.85
FLT3 P36888 4/20 0.85
KDR P35968 2/20 0.85
AXL P30530 2/20 0.85
PLK4 O00444 1/20 0.85
STK25 O00506 1/20 0.85
CIT O14578 1/20 0.85
AURKA O14965 1/20 0.85
CHUK O15111 1/20 0.85
MUSK O15146 1/20 0.85
EPHB6 O15197 1/20 0.85
MAPK13 O15264 1/20 0.85
MAP3K13 O43283 1/20 0.85
DAPK3 O43293 1/20 0.85
MAP3K7 O43318 1/20 0.85
RIPK2 O43353 1/20 0.85
JAK2 O60674 1/20 0.85
ROCK2 O75116 1/20 0.85
PAK3 O75914 1/20 0.85
CDKL5 O76039 1/20 0.85

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
SCHEMBL371942 1.00 MET (0.85) METFLT3KDRAXLPLK4
SCHEMBL19373139 1.00 MET (0.85) METFLT3KDRAXLPLK4
SCHEMBL372157 1.00 MET (0.85) METFLT3KDRAXLPLK4
SCHEMBL4405592 1.00 MET (0.85) METFLT3KDRAXLPLK4
SCHEMBL372156 1.00 MET (0.85) METFLT3KDRAXLPLK4
SCHEMBL29693469 1.00 MET (0.85) METFLT3KDRAXLPLK4
SCHEMBL20216838 0.94 MET (0.75) METFLT3KDRAXLPLK4
SCHEMBL15580161 0.93 MET (0.73) METFLT3KDRAXLPLK4
SCHEMBL12443865 0.93 MET (0.73) METFLT3KDRAXLPLK4
SCHEMBL372006 0.93 MET (0.73) METFLT3KDRAXLPLK4

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
EP-3329918-B1 C-MET MODULATORS AND METHODS OF USE EXELIXIS INC (US) 2022-05-25 EP claimed
EP-3329918-B1 C-MET MODULATORS AND METHODS OF USE EXELIXIS INC (US) 2022-05-25 EP disclosed