SCHEMBL7696289

SCHEMBL7696289

COc1ccc(OC)c(Nc2nc3cc4ccccc4cc3nc2-c2cccs2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.58
MAPT P10636 7/20 0.58
MEN1 O00255 6/20 0.58
MAPK1 P28482 4/20 0.58
GAA P10253 2/20 0.58
HSD17B10 Q99714 2/20 0.58
KDM4E B2RXH2 4/20 0.56
L3MBTL1 Q9Y468 3/20 0.56
LMNA P02545 2/20 0.56
RPS6KB2 Q9UBS0 3/20 0.54
PGK1 P00558 1/20 0.53
ALDH1A1 P00352 3/20 0.50
NFKB1 P19838 2/20 0.50
RAB9A P51151 2/20 0.50
NFKB2 Q00653 2/20 0.50
RELA Q04206 2/20 0.50
NPC1 O15118 1/20 0.50
TP53 P04637 2/20 0.47
USP2 O75604 1/20 0.46
ALOX15 P16050 1/20 0.46

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
SCHEMBL7697803 0.83 ABCG2 (0.62) KMT2AMAPTMEN1MAPK1HSD17B10
SCHEMBL7699357 0.83 KMT2A (0.62) KMT2AMAPTMEN1MAPK1GAA
SCHEMBL7697753 0.76 RPS6KB2 (0.60) KMT2AMAPTMEN1MAPK1GAA
SCHEMBL7692003 0.74 RPS6KB2 (0.53) KMT2AMAPTMEN1MAPK1GAA
SCHEMBL7697776 0.74 RPS6KB2 (0.53) KMT2AMAPTMEN1MAPK1GAA
SCHEMBL6237742 0.74 RPS6KB2 (0.69) KMT2AMAPTMEN1GAAHSD17B10
SCHEMBL14366834 0.74 MEN1 (1.00) KMT2AMAPTMEN1MAPK1GAA
SCHEMBL4019259 0.73 MAPT (0.54) KMT2AMAPTMEN1GAAKDM4E
SCHEMBL4019884 0.73 MAPT (0.54) KMT2AMAPTMEN1GAAKDM4E
SCHEMBL4025568 0.73 MAPT (0.54) KMT2AMAPTMEN1GAAKDM4E

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-2002094796-A2 BENZO[G]QUINOXALINE DERIVATIVES AS EFFECTIVE COMPOUNDS AGAINST INFECTIOUS DISEASES AXXIMA PHARMACEUTICALS AG (DE) 2002-11-28 WO disclosed