SCHEMBL5411428

SCHEMBL5411428

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

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AXL P30530 6/20 0.60
MET P08581 10/20 0.52
FLT3 P36888 3/20 0.52
FGFR2 P21802 1/20 0.48
KDR P35968 1/20 0.46
EGFR P00533 2/20 0.45
SRC P12931 1/20 0.44

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 0.90 AXL (0.65) AXLMETFLT3FGFR2KDR
SCHEMBL29693573 0.90 AXL (0.65) AXLMETFLT3FGFR2KDR
SCHEMBL3544369 0.86 MET (0.58) AXLMETFLT3KDR
SCHEMBL168001 0.86 AXL (0.54) AXLMETFLT3KDR
SCHEMBL2744533 0.86 MET (0.60) AXLMETFLT3FGFR2KDR
SCHEMBL5571100 0.83 MET (0.57) AXLMETFLT3KDREGFR
SCHEMBL371845 0.82 AXL (0.61) AXLMETFLT3KDREGFR
SCHEMBL166914 0.81 AXL (0.67) AXLMETFGFR2KDRSRC
SCHEMBL15338423 0.80 EGFR (0.63) AXLMETFLT3FGFR2KDR
Hydrochloric Acid SCHEMBL30388215 0.80 AXL (0.66) AXLMETFGFR2KDRSRC

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
WO-2007033196-A1 MET KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-03-22 WO disclosed