SCHEMBL8900788

SCHEMBL8900788

O=C(O)Oc1ccc2c(c1)C(=O)c1cc(OC(=O)O)ccc1-2

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
ALDH1A1 P00352 2/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
GAA P10253 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
TTR P02766 1/20 0.41
CHRNA7 P36544 1/20 0.41
PTGES O14684 1/20 0.40
PTPRC P08575 1/20 0.40

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
SCHEMBL10526608 0.96 MAPT (0.49) MAPTL3MBTL1ALDH1A1KMT2AMEN1
SCHEMBL17554244 0.93 TTR (0.53) MAPTL3MBTL1ALDH1A1KMT2AMEN1
SCHEMBL10529319 0.91 MAPT (0.49) MAPTL3MBTL1ALDH1A1KMT2AMEN1
SCHEMBL3912083 0.90 TTR (0.55) MAPTL3MBTL1ALDH1A1KMT2AMEN1
SCHEMBL10528839 0.89 S100A4 (0.55) MAPTL3MBTL1ALDH1A1KMT2AMEN1
SCHEMBL6261936 0.89 PTPRC (0.56) MAPTL3MBTL1ALDH1A1KMT2AMEN1
SCHEMBL10526615 0.87 S100A4 (0.53) MAPTL3MBTL1ALDH1A1KMT2AMEN1
SCHEMBL22336250 0.86 MAPT (0.55) MAPTL3MBTL1ALDH1A1KMT2AMEN1
SCHEMBL10528826 0.85 MAPT (0.41) MAPTL3MBTL1ALDH1A1KMT2AMEN1
SCHEMBL10529310 0.85 MAPT (0.54) MAPTL3MBTL1ALDH1A1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0147226-B1 VISIBLE LIGHT ABSORBING PEROXY ESTERS LOCTITE CORPORATION (US) 1989-11-23 EP claimed
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