SCHEMBL17422130

SCHEMBL17422130

O=C(c1ccccc1)C1(S)O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HK1 P19367 2/20 0.41
▸ HK2 P52789 2/20 0.41
▸ LGALS9 O00182 2/20 0.39
▸ LGALS1 P09382 2/20 0.39
▸ LGALS3 P17931 2/20 0.39
▸ LGALS7; LGALS7B P47929 2/20 0.39
▸ PYGL P06737 2/20 0.38
▸ PYGB P11216 2/20 0.38
▸ PYGM P11217 1/20 0.38
▸ ALDH1A1 P00352 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
SCHEMBL10771475 0.81 LGALS9 (0.39) HK1HK2LGALS9LGALS1LGALS3
SCHEMBL27936287 0.79 PYGB (0.44) PYGLPYGBPYGM
SCHEMBL6131050 0.78 PYGB (0.43) PYGLPYGBPYGM
SCHEMBL27798338 0.77 LGALS9 (0.40) HK1HK2LGALS9LGALS1LGALS3
SCHEMBL14674782 0.76 SLC5A2 (0.41) —
SCHEMBL30843273 0.76 LGALS9 (0.40) HK1HK2LGALS9LGALS1LGALS3
SCHEMBL3839216 0.75 LGALS9 (0.38) HK1HK2LGALS9LGALS1LGALS3
SCHEMBL3232264 0.74 PYGB (0.50) PYGLPYGBPYGM
SCHEMBL7454320 0.74 PYGB (0.43) PYGLPYGBPYGM
SCHEMBL31680369 0.74 LGALS9 (0.37) HK1HK2LGALS9LGALS1LGALS3

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-3166957-A1 SULFATED-GLYCOLIPIDS AS ADJUVANTS FOR VACCINES National Research Council of Canada (CA) 2017-05-17 — — EP disclosed
WO-2016004512-A1 SULFATED-GLYCOLIPIDS AS ADJUVANTS FOR VACCINES NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2016-01-14 — — WO disclosed
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