SCHEMBL7553587

SCHEMBL7553587

O=C(C[C@@]1(O)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ MMP9 P14780 1/20 0.40
▸ MMP8 P22894 1/20 0.40
▸ MAPK1 P28482 2/20 0.39
▸ TRPA1 O75762 1/20 0.39
▸ GSK3B P49841 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ LGALS9 O00182 2/20 0.38
▸ LGALS1 P09382 2/20 0.38
▸ LGALS3 P17931 2/20 0.38
▸ LGALS7; LGALS7B P47929 2/20 0.38
▸ HK1 P19367 2/20 0.38
▸ HK2 P52789 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ CES1 P23141 1/20 0.37

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
SCHEMBL7554376 1.00 ALDH1A1 (0.41) ALDH1A1MAPTMMP9MMP8MAPK1
SCHEMBL7556458 1.00 ALDH1A1 (0.41) ALDH1A1MAPTMMP9MMP8MAPK1
SCHEMBL7555317 1.00 ALDH1A1 (0.41) ALDH1A1MAPTMMP9MMP8MAPK1
SCHEMBL7548950 1.00 ALDH1A1 (0.41) ALDH1A1MAPTMMP9MMP8MAPK1
SCHEMBL7556738 1.00 ALDH1A1 (0.41) ALDH1A1MAPTMMP9MMP8MAPK1
SCHEMBL7548243 0.96 MAPT (0.42) ALDH1A1MAPTMMP9MMP8MAPK1
SCHEMBL7557071 0.96 MAPT (0.42) ALDH1A1MAPTMMP9MMP8MAPK1
SCHEMBL7552663 0.81 MMP9 (0.44) ALDH1A1MAPTMMP9MMP8MAPK1
SCHEMBL29836760 0.80 PYGB (0.41) MEN1KMT2A
SCHEMBL18385978 0.80 PYGB (0.41) MEN1KMT2A

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
WO-2002051803-A2 NOVEL C-GLYCOSIDE DERIVATIVES AND USE THEREOF L'OREAL (FR) 2002-07-04 — — WO claimed
WO-2002051803-A2 NOVEL C-GLYCOSIDE DERIVATIVES AND USE THEREOF L'OREAL (FR) 2002-07-04 — — WO disclosed
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