SCHEMBL29693573

SCHEMBL29693573

COc1cc2c(Oc3ccc(N)cc3F)ccnc2cc1OCC1CCN(C)CC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 2/20 0.65
MET P08581 5/20 0.62
EGFR P00533 13/20 0.54
PDPK1 O15530 1/20 0.52
FGFR1 P11362 6/20 0.51
FLT1 P17948 6/20 0.51
FLT4 P35916 6/20 0.51
KDR P35968 6/20 0.51
PDGFRB P09619 2/20 0.51
TEK Q02763 2/20 0.51
FLT3 P36888 2/20 0.51
BMPR1B O00238 1/20 0.51
PLK4 O00444 1/20 0.51
CIT O14578 1/20 0.51
GAK O14976 1/20 0.51
EPHB6 O15197 1/20 0.51
RIPK2 O43353 1/20 0.51
ROCK2 O75116 1/20 0.51
STK10 O94804 1/20 0.51
MAP4K4 O95819 1/20 0.51

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
SCHEMBL371859 1.00 AXL (0.65) AXLMETEGFRPDPK1FGFR1
SCHEMBL5411428 0.90 AXL (0.60) AXLMETEGFRKDRFLT3
SCHEMBL15338423 0.90 EGFR (0.63) AXLMETEGFRFGFR1FLT1
SCHEMBL3544369 0.89 MET (0.58) AXLMETKDRFLT3
SCHEMBL2744533 0.88 MET (0.60) AXLMETEGFRFGFR1FLT1
SCHEMBL14313711 0.88 MET (0.60) AXLMETEGFRFGFR1FLT1
SCHEMBL371845 0.88 AXL (0.61) AXLMETEGFRFLT1KDR
SCHEMBL371889 0.85 MET (0.60) AXLMETEGFRFGFR1FLT1
SCHEMBL20216820 0.85 MET (0.66) AXLMETEGFRFLT3PLK4
SCHEMBL168001 0.85 AXL (0.54) AXLMETKDRFLT3

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 disclosed