SCHEMBL31680369

SCHEMBL31680369

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

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LGALS9 O00182 2/20 0.37
▸ LGALS1 P09382 2/20 0.37
▸ LGALS3 P17931 2/20 0.37
▸ LGALS7; LGALS7B P47929 2/20 0.37
▸ HK1 P19367 2/20 0.37
▸ HK2 P52789 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ PYGL P06737 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MAOB P27338 1/20 0.34

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
SCHEMBL10771475 0.87 LGALS9 (0.39) LGALS9LGALS1LGALS3LGALS7; LGALS7BHK1
SCHEMBL30843273 0.85 LGALS9 (0.40) LGALS9LGALS1LGALS3LGALS7; LGALS7BHK1
SCHEMBL30702562 0.76 PYGB (0.43) LGALS3PYGLLMNA
SCHEMBL17422130 0.74 HK1 (0.41) LGALS9LGALS1LGALS3LGALS7; LGALS7BHK1
SCHEMBL23832488 0.74 PYGB (0.39) PYGL
SCHEMBL30368413 0.74 PYGB (0.39) PYGL
SCHEMBL29355853 0.74 PYGB (0.39) PYGL
SCHEMBL30865647 0.74 PYGB (0.39) PYGL
SCHEMBL31680333 0.74 PYGB (0.39) PYGL
SCHEMBL30256833 0.74 PYGB (0.39) PYGL

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-20250275993-A1 GLYCOSYLATION INHIBITORS AS THERAPEUTICS FOR STROKE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2025-09-04 — — US disclosed
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