SCHEMBL17048868

SCHEMBL17048868

CC[Si](CC)(CC)OCC(c1c(Cl)ccc(F)c1Cl)[N+](=O)[O-]

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MET P08581 15/20 0.34
KDR P35968 6/20 0.33
FGFR2 P21802 2/20 0.33
AXL P30530 2/20 0.33
FLT3 P36888 2/20 0.33
MST1R Q04912 2/20 0.33
AURKA O14965 1/20 0.33
ABL1 P00519 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33
YES1 P07947 1/20 0.33
EPHA2 P29317 1/20 0.33
LTK P29376 1/20 0.33
PTK6 Q13882 1/20 0.33
INPPL1 O15357 4/20 0.32
SRC P12931 3/20 0.32
KIT P10721 1/20 0.32
ALK Q9UM73 1/20 0.32

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
SCHEMBL17048785 0.82 CNR1 (0.32)
SCHEMBL17048866 0.77 MET (0.34) METKDRFGFR2AXLFLT3
SCHEMBL17048975 0.77 ALDH1A1 (0.31)
SCHEMBL17048815 0.76 TDP1 (0.33) METKDRFGFR2AXLFLT3
SCHEMBL17048776 0.76 MAPT (0.37)
SCHEMBL5078043 0.73 ALDH1A1 (0.36)
SCHEMBL17048914 0.69 MET (0.40) METKDRFGFR2AXLFLT3
Hydrochloric Acid SCHEMBL17048923 0.68 MET (0.40) METKDRFGFR2AXLFLT3
SCHEMBL17048880 0.67
SCHEMBL17048813 0.65 ALDH1A1 (0.45) METKDRFGFR2AXLFLT3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3110810-A1 PYRAZOLE AMIDE DERIVATIVE Teijin Pharma Limited (JP) 2017-01-04 EP disclosed
WO-2015129926-A1 PYRAZOLE AMIDE DERIVATIVE TEIJIN PHARMA LIMITED (JP) 2015-09-03 WO disclosed