SCHEMBL10989656

SCHEMBL10989656

COc1ccc(-c2nc(Cl)[nH]c2-c2ccc(OC)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 1/20 0.59
MAPT P10636 5/20 0.54
TP53 P04637 2/20 0.54
MAPK13 O15264 2/20 0.54
MAPK12 P53778 2/20 0.54
MAPK11 Q15759 2/20 0.54
MAPK14 Q16539 2/20 0.54
SMPD3 Q9NY59 1/20 0.54
PDE10A Q9Y233 1/20 0.54
RAF1 P04049 1/20 0.54
ALOX5 P09917 1/20 0.52
GCGR P47871 1/20 0.52
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
LMNA P02545 3/20 0.51
TDP1 Q9NUW8 3/20 0.51
HTT P42858 2/20 0.51
MAPK1 P28482 1/20 0.51
ALDH1A1 P00352 4/20 0.50

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
SCHEMBL8356566 0.94 MAPT (0.63) NOX1MAPTTP53MAPK13MAPK12
SCHEMBL3455232 0.82 NOX1 (0.77) NOX1MAPTTP53MAPK13MAPK12
SCHEMBL6464698 0.81 NOX1 (0.74) NOX1MAPTTP53MAPK13MAPK12
SCHEMBL9749306 0.81 HPGD (0.62) NOX1MAPTTP53MAPK13MAPK12
SCHEMBL15400824 0.81 NOX1 (0.85) NOX1MAPTTP53MAPK13MAPK12
SCHEMBL8008805 0.81 NOX1 (0.85) NOX1MAPTTP53MAPK13MAPK12
SCHEMBL5441279 0.80 NOX1 (0.52) NOX1MAPTTP53MAPK13MAPK12
SCHEMBL5434851 0.79 NOX1 (0.59) NOX1MAPTTP53MAPK13MAPK12
SCHEMBL10993607 0.79 NOX1 (0.59) NOX1MAPTTP53MAPK13MAPK12
SCHEMBL10814349 0.78 NOX1 (0.57) NOX1MAPTTP53MAPK13MAPK12

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
US-4503065-A ANTIARTHRITIC, ANALGESIC E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-03-05 US disclosed