SCHEMBL29693458

SCHEMBL29693458

COc1cc2c(Oc3ccc(NC(=O)[C@]4(C(=O)Nc5ccc(F)cc5)C[C@@H]4C)cc3F)ccnc2cc1OCCCN1CCN(C)CC1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 18/20 0.73
KIT P10721 7/20 0.73
FLT3 P36888 7/20 0.73
KDR P35968 6/20 0.73
EGFR P00533 5/20 0.73
AXL P30530 5/20 0.73
PDGFRB P09619 4/20 0.73
PDGFRA P16234 4/20 0.73
ALK Q9UM73 3/20 0.73
MST1R Q04912 3/20 0.73
FLT4 P35916 2/20 0.73
FLT1 P17948 2/20 0.73
PLK4 O00444 2/20 0.73
AURKA O14965 2/20 0.73
RIPK2 O43353 2/20 0.73
STK10 O94804 2/20 0.73
MAP4K4 O95819 2/20 0.73
FYN P06241 2/20 0.73
YES1 P07947 2/20 0.73
LYN P07948 2/20 0.73

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
SCHEMBL372270 1.00 MET (0.73) METKITFLT3KDREGFR
SCHEMBL371938 1.00 MET (0.73) METKITFLT3KDREGFR
SCHEMBL22566433 1.00 MET (0.73) METKITFLT3KDREGFR
SCHEMBL29693479 1.00 MET (0.73) METKITFLT3KDREGFR
SCHEMBL3832582 0.94 MET (0.70) METKITFLT3KDREGFR
SCHEMBL4410650 0.93 MET (0.69) METKITFLT3KDREGFR
SCHEMBL22566439 0.93 MET (0.71) METKITFLT3KDREGFR
SCHEMBL371863 0.93 MET (0.71) METKITFLT3KDREGFR
SCHEMBL22553045 0.93 MET (0.84) METKITFLT3KDREGFR
SCHEMBL371769 0.93 MET (0.71) METKITFLT3KDREGFR

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