SCHEMBL5394522

SCHEMBL5394522

CO[C@H]1O[C@H](CO)[C@](O)([C@@H]2O[C@H](CO)[C@H](O)[C@@H](NS(C)(=O)=O)[C@H]2O)[C@H](O)[C@@H]1NC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
LGALS3 P17931 4/20 0.39
LGALS1 P09382 1/20 0.39
LGALS7; LGALS7B P47929 1/20 0.39
ALDH1A1 P00352 1/20 0.37
THRB P10828 1/20 0.37
MAPK1 P28482 1/20 0.36
LGALS9 O00182 1/20 0.36

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
SCHEMBL7112857 0.85 LGALS3 (0.40) CA1CA2CA9LGALS3LGALS1
SCHEMBL5399353 0.84 LGALS3 (0.40) CA1CA2CA9LGALS3LGALS1
SCHEMBL5482774 0.83 CA1 (0.42) CA1CA2CA9LGALS3LGALS1
SCHEMBL5398983 0.82 LGALS3 (0.53) CA1CA2CA9LGALS3LGALS1
SCHEMBL5436171 0.82 LGALS3 (0.39) CA1CA2CA9LGALS3LGALS1
SCHEMBL5495152 0.81 LGALS3 (0.55) CA1CA2CA9LGALS3LGALS1
SCHEMBL5389956 0.81 LGALS3 (0.40) CA1CA2CA9LGALS3LGALS1
SCHEMBL5389972 0.81 LGALS3 (0.47) LGALS3LGALS1LGALS7; LGALS7BLGALS9
SCHEMBL5391745 0.81 LGALS3 (0.55) CA1CA2CA9LGALS3LGALS1
SCHEMBL5404178 0.80 LGALS3 (0.58) CA1CA2CA9LGALS3LGALS1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2919802-A1 METHODS, COMPOSITIONS AND KITS FOR TREATING, MODULATING, OR PREVENTING OCULAR ANGIOGENESIS OR FIBROSIS IN A SUBJECT USING A GALECTIN PROTEIN INHIBITOR Tufts University (US) 2015-09-23 EP claimed
WO-2014078655-A1 METHODS, COMPOSITIONS AND KITS FOR TREATING, MODULATING, OR PREVENTING OCULAR ANGIOGENESIS OR FIBROSIS IN A SUBJECT USING A GALECTIN PROTEIN INHIBITOR TUFTS UNIVERSITY (US) 2014-05-22 WO claimed
JP-2007508328-A 2007-04-05 JP claimed
EP-1682159-A1 IMMUNOMODULATING COMPOSITIONS AND USES THEREFOR Ralph, John Stephen (AU) 2006-07-26 EP claimed
WO-2005037293-A1 IMMUNOMODULATING COMPOSITIONS AND USES THEREFOR UNIV MONASH (AU) 2005-04-28 WO claimed
EP-1682159-A1 IMMUNOMODULATING COMPOSITIONS AND USES THEREFOR Ralph, John Stephen (AU) 2006-07-26 EP disclosed
WO-2005037293-A1 IMMUNOMODULATING COMPOSITIONS AND USES THEREFOR UNIV MONASH (AU) 2005-04-28 WO disclosed
EP-1353934-A1 NEW INHIBITORS AGAINST GALECTINS Nilsson, Ulf (SE) 2003-10-22 EP disclosed
WO-2002057284-A1 NEW INHIBITORS AGAINST GALECTINS NILSSON ULF (SE) 2002-07-25 WO disclosed