SCHEMBL8300100

SCHEMBL8300100

O=C1Nc2ccccc2/C1=C\c1ccc(O)c2ncccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP3K7 O43318 1/20 0.62
TAB1 Q15750 1/20 0.62
CHEK1 O14757 1/20 0.61
PLK4 O00444 2/20 0.59
PLK1 P53350 2/20 0.59
GSK3B P49841 1/20 0.54
RET P07949 3/20 0.54
TDP1 Q9NUW8 1/20 0.54
NPC1 O15118 2/20 0.52
KDM4E B2RXH2 1/20 0.52
MEN1 O00255 1/20 0.52
HSP90AA1 P07900 1/20 0.52
IDO1 P14902 1/20 0.52
RAB9A P51151 1/20 0.52
KMT2A Q03164 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
FLT3 P36888 4/20 0.51
NTRK1 P04629 3/20 0.51
PDGFRB P09619 2/20 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
SCHEMBL7872417 1.00 MAP3K7 (0.62) MAP3K7TAB1CHEK1PLK4PLK1
SCHEMBL5201417 0.91 PLK4 (0.62) MAP3K7TAB1CHEK1PLK4PLK1
SCHEMBL8099054 0.87 PDPK1 (0.50) MAP3K7TAB1CHEK1PLK4PLK1
SCHEMBL8319397 0.87 RAF1 (0.60) MAP3K7TAB1CHEK1PLK4PLK1
SCHEMBL8099022 0.85 FLT3 (0.53) MAP3K7TAB1CHEK1NPC1KDM4E
SCHEMBL8099485 0.85 DHFR (0.52) MAP3K7TAB1CHEK1PLK4PLK1
SCHEMBL8099047 0.85 PLK4 (0.56) MAP3K7TAB1CHEK1PLK4PLK1
SCHEMBL8348594 0.85 KDM4E (0.52) MAP3K7TAB1CHEK1PLK4PLK1
SCHEMBL8300232 0.83 MAP3K7 (0.72) MAP3K7TAB1CHEK1PLK4PLK1
SCHEMBL7878474 0.83 MAP3K7 (0.72) MAP3K7TAB1CHEK1PLK4PLK1

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-0662473-B1 2-Oxindole derivatives as tyrosine kinase inhibitors PHARMACIA & UPJOHN SPA (IT) 1999-09-01 EP claimed