SCHEMBL18653399

SCHEMBL18653399

O=S(=O)(O)OC1C(O)COC(CO)C1O

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 2/20 0.33
▸ SLC6A2 P23975 1/20 0.32
▸ CA12 O43570 2/20 0.32
▸ CA2 P00918 2/20 0.32
▸ CA9 Q16790 2/20 0.32
▸ CA1 P00915 1/20 0.32
▸ GAA P10253 1/20 0.31
▸ MGAM O43451 1/20 0.31

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
SCHEMBL23603158 0.75 LGALS3 (0.37) LGALS3SLC6A2GAAMGAM
SCHEMBL8719944 0.75 LGALS3 (0.37) LGALS3SLC6A2GAAMGAM
SCHEMBL27207966 0.75 LGALS3 (0.37) LGALS3SLC6A2GAAMGAM
SCHEMBL23603330 0.75 LGALS3 (0.37) LGALS3SLC6A2GAAMGAM
SCHEMBL22423210 0.75 LGALS3 (0.37) LGALS3SLC6A2GAAMGAM
SCHEMBL9422089 0.75 LGALS3 (0.41) LGALS3CA12CA2CA9CA1
SCHEMBL21335363 0.75 — —
SCHEMBL741519 0.74 SLC2A1 (0.42) LGALS3CA12CA2CA9CA1
SCHEMBL5318200 0.74 SLC2A1 (0.42) LGALS3CA12CA2CA9CA1
SCHEMBL150778 0.74 SLC2A1 (0.42) LGALS3CA12CA2CA9CA1

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
WO-2017046172-A1 CARBOHYDRATE LIGANDS THAT BIND TO ANTIBODIES AGAINST GLYCOEPITOPES OF GLYCOSPHINGOLIPIDS UNIVERSITÄT BASEL (CH) 2017-03-23 — — WO disclosed
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