SCHEMBL29535345

SCHEMBL29535345

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

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 2/20 0.38
▸ F10 P00742 2/20 0.37
▸ MAPK1 P28482 1/20 0.35
▸ CA12 O43570 7/20 0.35
▸ CA9 Q16790 7/20 0.35
▸ CA1 P00915 6/20 0.35
▸ CA2 P00918 6/20 0.35
▸ KDM4E B2RXH2 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ AMDHD2 Q9Y303 1/20 0.31
▸ HK1 P19367 1/20 0.30
▸ HK2 P52789 1/20 0.30
▸ F2 P00734 1/20 0.30
▸ SERPINC1 P01008 1/20 0.30

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
SCHEMBL29535657 0.90 LGALS3 (0.36) LGALS3F10MAPK1CA12CA9
SCHEMBL29535299 0.88 MAPK1 (0.40) LGALS3F10MAPK1CA12CA9
SCHEMBL16728933 0.88 MAPK1 (0.40) LGALS3F10MAPK1CA12CA9
SCHEMBL29535532 0.86 F10 (0.48) LGALS3F10F2SERPINC1
SCHEMBL16729068 0.83 LGALS3 (0.36) LGALS3F10MAPK1CA12CA9
SCHEMBL28201089 0.82 LGALS3 (0.38) LGALS3CA12CA9CA1CA2
SCHEMBL870879 0.82 LGALS3 (0.38) LGALS3CA12CA9CA1CA2
SCHEMBL3914085 0.82 LGALS3 (0.38) LGALS3CA12CA9CA1CA2
SCHEMBL2186684 0.82 LGALS3 (0.38) LGALS3CA12CA9CA1CA2
SCHEMBL23631136 0.82 MAPK1 (0.52) LGALS3MAPK1KDM4ELMNACYP2D6

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
US-20240366853-A1 METHOD FOR MODULATING ENDOTHELIAL GLYCOCALYX STRUCTURE EXTHERA MEDICAL CORPORATION (US) 2024-11-07 — — US disclosed
US-12090261-B2 Method for modulating endothelial glycocalyx structure EXTHERA MEDICAL CORPORATION (US) 2024-09-17 — — US disclosed
EP-3969014-A1 METHOD FOR MODULATING ENDOTHELIAL GLYCOCALYX STRUCTURE ExThera Medical Corporation (US) 2022-03-23 — — EP disclosed
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