SCHEMBL3391902

SCHEMBL3391902

C[C@@H](Oc1cccnc1NBr)c1c(Cl)ccc(F)c1Cl

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MET P08581 16/20 0.69
SRC P12931 2/20 0.55
KDR P35968 2/20 0.55
KIT P10721 1/20 0.55
FGFR2 P21802 1/20 0.55
AXL P30530 1/20 0.55
FLT3 P36888 1/20 0.55
MST1R Q04912 1/20 0.55
JAK2 O60674 1/20 0.52
INPPL1 O15357 3/20 0.43

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
SCHEMBL488259 0.82 MET (0.46) METSRCKDRKITFGFR2
SCHEMBL488751 0.81 MET (1.00) METSRCKDRKITFGFR2
SCHEMBL3120131 0.81 MET (1.00) METSRCKDRKITFGFR2
SCHEMBL15133818 0.81 MET (1.00) METSRCKDRKITFGFR2
SCHEMBL29529122 0.81 MET (1.00) METSRCKDRKITFGFR2
SCHEMBL30453522 0.81 JAK2 (0.74) METJAK2INPPL1
SCHEMBL28607434 0.79 MET (0.57) METSRCKDRKITFGFR2
SCHEMBL27650269 0.79 MET (0.60) METSRCKDRKITFGFR2
SCHEMBL31494646 0.77 MET (0.66) METSRCKDRKITFGFR2
SCHEMBL3113351 0.77 MET (0.66) METSRCKDRKITFGFR2

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-1784396-B1 PYRAZOLE-SUBSTITUTED AMINOHETEROARYL COMPOUNDS AS PROTEIN KINASE INHIBITORS PFIZER (US) 2010-12-22 EP disclosed