SCHEMBL9682411

SCHEMBL9682411

O=C(C=Cc1ccc(O)c(O)c1)OCC=Cc1ccc(O)c(O)c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 13/20 0.76
TTR P02766 6/20 0.72
DPP4 P27487 2/20 0.70
AKR1B10 O60218 3/20 0.63
AKR1B1 P15121 3/20 0.63
HSD17B10 Q99714 4/20 0.60
ALOX15 P16050 3/20 0.60
CYP3A4 P08684 3/20 0.60
MAPK1 P28482 3/20 0.60
TDP1 Q9NUW8 3/20 0.60
ALOX12 P18054 2/20 0.60
TP53 P04637 2/20 0.60
KDM4E B2RXH2 2/20 0.60
MEN1 O00255 2/20 0.60
ALDH1A1 P00352 2/20 0.60
LMNA P02545 2/20 0.60
ALOX5 P09917 2/20 0.60
MAPT P10636 2/20 0.60
HPGD P15428 2/20 0.60
PMP22 Q01453 2/20 0.60

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
SCHEMBL29578214 1.00 APP (0.76) APPTTRDPP4AKR1B10AKR1B1
SCHEMBL29577718 0.94 APP (0.68) APPTTRDPP4AKR1B10AKR1B1
SCHEMBL29577930 0.94 APP (0.68) APPTTRDPP4AKR1B10AKR1B1
SCHEMBL20914984 0.93 TTR (0.67) APPTTRDPP4AKR1B10AKR1B1
SCHEMBL20914982 0.93 TTR (0.67) APPTTRDPP4AKR1B10AKR1B1
SCHEMBL25199144 0.93 TTR (0.67) APPTTRDPP4AKR1B10AKR1B1
SCHEMBL1659848 0.93 TTR (0.67) APPTTRDPP4AKR1B10AKR1B1
SCHEMBL20941431 0.93 TTR (0.67) APPTTRDPP4AKR1B10AKR1B1
SCHEMBL20914981 0.93 TTR (0.67) APPTTRDPP4AKR1B10AKR1B1
SCHEMBL20914983 0.93 TTR (0.67) APPTTRDPP4AKR1B10AKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0466198-A1 A lipoxygenase inhibitor GREEN CROSS CORPORATION (JP) 1992-01-15 EP disclosed
EP-0466197-A1 A lipoxygenase inhibitor GREEN CROSS CORPORATION (JP) 1992-01-15 EP disclosed
EP-0464859-A1 A lipoxygenase inhibitor GREEN CROSS CORPORATION (JP) 1992-01-08 EP disclosed
EP-0464858-A1 A lipoxygenase inhibitor GREEN CROSS CORPORATION (JP) 1992-01-08 EP disclosed
US-4733002-A Lipoxygenase inhibitor GREEN CROSS CORPORATION (JP) 1988-03-22 US disclosed
EP-0163270-A2 A lipoxygenase inhibitor GREEN CROSS CORPORATION (JP) 1985-12-04 EP disclosed