SCHEMBL8901347

SCHEMBL8901347

COC(=O)Oc1ccccc1/C=C\c1ccccc1OC(=O)OC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.58
HPGD P15428 2/20 0.58
HSD17B10 Q99714 1/20 0.58
NFE2L2 Q16236 6/20 0.54
TFEB P19484 1/20 0.53
MAPT P10636 4/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
LMNA P02545 2/20 0.47
BCHE P06276 1/20 0.47
TRPA1 O75762 1/20 0.47
MAPK1 P28482 1/20 0.46
ATM Q13315 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 2/20 0.45
JAK2 O60674 1/20 0.45
GAA P10253 1/20 0.45
HTT P42858 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL9242510 0.92 NFE2L2 (0.62) KDM4EHPGDHSD17B10NFE2L2TFEB
SCHEMBL1665178 0.89 HPGD (0.58) KDM4EHPGDHSD17B10NFE2L2TFEB
SCHEMBL26667032 0.88 GAA (0.60) KDM4EHPGDHSD17B10NFE2L2TFEB
SCHEMBL8900889 0.87 NFE2L2 (0.49) KDM4EHPGDHSD17B10NFE2L2TFEB
SCHEMBL7542596 0.85 KDM4E (0.54) KDM4EHPGDHSD17B10NFE2L2TFEB
SCHEMBL8901624 0.84 NFE2L2 (0.59) KDM4EHPGDHSD17B10NFE2L2MAPT
SCHEMBL8900072 0.84 NFE2L2 (0.59) KDM4EHPGDHSD17B10NFE2L2MAPT
SCHEMBL11925422 0.83 KDM4E (0.70) KDM4EHPGDHSD17B10MAPTNPC1
SCHEMBL31312540 0.82 NFE2L2 (0.52) KDM4EHPGDNFE2L2TFEBMAPT
SCHEMBL14775180 0.81 NFE2L2 (0.49) KDM4EHPGDHSD17B10NFE2L2TFEB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0663391-B1 Sulphuric acid esters of sugar alcohols for the treatment of arteriosclerotic changes in the vascular walls HOFFMANN LA ROCHE (CH) 1997-04-09 EP disclosed
EP-0663391-A1 Sulphuric acid esters of sugar alcohols for the treatment of arteriosclerotic changes in the vascular walls F. HOFFMANN-LA ROCHE AG (CH) 1995-07-19 EP disclosed