SCHEMBL29693449

SCHEMBL29693449

COc1cc2c(Oc3ccc(NC(=O)[C@]4(C(=O)Nc5ccc(F)cc5)C[C@H]4C)cc3F)ccnc2cc1OCCCN1CCNCC1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 19/20 0.71
KDR P35968 7/20 0.71
KIT P10721 5/20 0.71
FLT3 P36888 5/20 0.71
AXL P30530 4/20 0.71
PDGFRB P09619 3/20 0.71
PDGFRA P16234 3/20 0.71
MST1R Q04912 3/20 0.71
FLT1 P17948 2/20 0.71
RET P07949 2/20 0.71
PLK4 O00444 1/20 0.71
STK25 O00506 1/20 0.71
CIT O14578 1/20 0.71
AURKA O14965 1/20 0.71
CHUK O15111 1/20 0.71
MUSK O15146 1/20 0.71
EPHB6 O15197 1/20 0.71
MAPK13 O15264 1/20 0.71
MAP3K13 O43283 1/20 0.71
DAPK3 O43293 1/20 0.71

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
SCHEMBL371769 1.00 MET (0.71) METKDRKITFLT3AXL
SCHEMBL371863 1.00 MET (0.71) METKDRKITFLT3AXL
SCHEMBL22566439 1.00 MET (0.71) METKDRKITFLT3AXL
SCHEMBL29693479 0.93 MET (0.73) METKDRKITFLT3AXL
SCHEMBL22566433 0.93 MET (0.73) METKDRKITFLT3AXL
SCHEMBL372270 0.93 MET (0.73) METKDRKITFLT3AXL
SCHEMBL371938 0.93 MET (0.73) METKDRKITFLT3AXL
SCHEMBL29693458 0.93 MET (0.73) METKDRKITFLT3AXL
SCHEMBL14556314 0.93 MET (0.72) METKDRKITFLT3AXL
SCHEMBL22553045 0.92 MET (0.84) METKDRKITFLT3AXL

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