SCHEMBL5711085

SCHEMBL5711085

O=C(Cc1ccc(F)cc1)NC(=S)Nc1ccc(Oc2c[c]ncn2)c(F)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 20/20 0.59
AXL P30530 2/20 0.59
KDR P35968 14/20 0.51
CYP3A4 P08684 1/20 0.49
PLK4 O00444 1/20 0.47
MAP4K4 O95819 1/20 0.47
ABL1 P00519 1/20 0.47
LCK P06239 1/20 0.47
FYN P06241 1/20 0.47
LYN P07948 1/20 0.47
HCK P08631 1/20 0.47
PDGFRB P09619 1/20 0.47
BCR P11274 1/20 0.47
SRC P12931 1/20 0.47
FLT3 P36888 1/20 0.47
ABL2 P42684 1/20 0.47
FRK P42685 1/20 0.47
SYK P43405 1/20 0.47
MST1R Q04912 1/20 0.47
DDR1 Q08345 1/20 0.47

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
SCHEMBL9958254 0.93 MET (0.59) METAXLKDRPDGFRB
SCHEMBL1136995 0.85 MET (0.60) METAXLKDRCYP3A4PLK4
SCHEMBL1136770 0.84 MET (0.64) METAXLKDRCYP3A4PLK4
SCHEMBL9958340 0.83 MET (0.52) METKDRCYP3A4
SCHEMBL1137038 0.83 RAF1 (0.65) METAXLKDRPDGFRB
SCHEMBL4330531 0.82 MET (0.55) METAXLKDRCYP3A4PLK4
SCHEMBL4328614 0.80 MET (0.55) METAXLKDRCYP3A4
SCHEMBL4326362 0.79 MET (0.52) METAXLKDRCYP3A4PLK4
SCHEMBL1136852 0.79 MET (0.53) METAXLKDRPLK4MAP4K4
SCHEMBL13861007 0.78 KDR (0.65) METAXLKDRMERTK

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-1719763-A1 NOVEL PYRIDINE DERIVATIVE AND PYRIMIDINE DERIVATIVE (2) Eisai Co., Ltd. (JP) 2006-11-08 EP disclosed