SCHEMBL2432167

SCHEMBL2432167

COc1cccc(C(=O)N[C@@H]2[C@@H](O)[C@@H](CO)O[C@@H](S[C@@H]3O[C@H](CO)[C@H](O)[C@@H](NC(=O)c4cccc(OC)c4)[C@H]3O)[C@@H]2O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 11/20 1.00
LGALS9 O00182 8/20 1.00
LGALS7; LGALS7B P47929 7/20 1.00
LGALS1 P09382 7/20 1.00
LGALS8 O00214 4/20 1.00
ALDH1A1 P00352 1/20 0.60
HK1 P19367 1/20 0.48
HK2 P52789 1/20 0.48
GAPDH P04406 1/20 0.47

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
SCHEMBL2432165 1.00 LGALS3 (1.00) LGALS3LGALS9LGALS7; LGALS7BLGALS1LGALS8
SCHEMBL13595433 1.00 LGALS3 (1.00) LGALS3LGALS9LGALS7; LGALS7BLGALS1LGALS8
SCHEMBL13595411 1.00 LGALS3 (1.00) LGALS3LGALS9LGALS7; LGALS7BLGALS1LGALS8
SCHEMBL17681050 0.95 LGALS3 (0.90) LGALS3LGALS9LGALS7; LGALS7BLGALS1LGALS8
SCHEMBL13595431 0.89 LGALS3 (1.00) LGALS3LGALS9LGALS7; LGALS7BLGALS1LGALS8
SCHEMBL2431469 0.89 LGALS3 (1.00) LGALS3LGALS9LGALS7; LGALS7BLGALS1LGALS8
SCHEMBL13595410 0.89 LGALS3 (1.00) LGALS3LGALS9LGALS7; LGALS7BLGALS1LGALS8
SCHEMBL2431473 0.89 LGALS3 (1.00) LGALS3LGALS9LGALS7; LGALS7BLGALS1LGALS8
SCHEMBL5433782 0.87 LGALS3 (0.79) LGALS3LGALS9LGALS7; LGALS7BLGALS1LGALS8
SCHEMBL15720435 0.87 LGALS3 (0.79) LGALS3LGALS9LGALS7; LGALS7BLGALS1LGALS8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150320782-A1 Methods, compositions and kits for treating, modulating, or preventing ocular angiogenesis or fibrosis in a subject using a galectin protein inhibitor NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-11-12 US claimed
EP-1751171-B1 NOVEL GALACTOSIDE INHIBITORS OF GALECTINS FORSKARPATENT I SYD AB (SE) 2011-09-21 EP claimed
US-7638623-B2 Galactoside inhibitors of galectins FORSKARPATENT I SYD AB (SE) 2009-12-29 US claimed
US-20070185039-A1 NOVEL GALACTOSIDE INHIBITORS OF GALECTINS GALECTO BIOTECH AB (SE) 2007-08-09 US claimed
US-20170095496-A1 GALACTOSIDE INHIBITORS FOR NEW USES GALECTO BIOTECH AB (DK) 2017-04-06 US disclosed
US-20150320782-A1 Methods, compositions and kits for treating, modulating, or preventing ocular angiogenesis or fibrosis in a subject using a galectin protein inhibitor NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-11-12 US disclosed
EP-1751171-B1 NOVEL GALACTOSIDE INHIBITORS OF GALECTINS FORSKARPATENT I SYD AB (SE) 2011-09-21 EP disclosed
US-7638623-B2 Galactoside inhibitors of galectins FORSKARPATENT I SYD AB (SE) 2009-12-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150320782-A1 Methods, compositions and kits for treating, modulating, or preventing ocular angiogenesis or fibrosis in a subject using a galectin protein inhibitor LGALS1, LGALS2, LGALS3BP LGALS3 4/4885LGALS9 7/4885LGALS7; LGALS7B 8/4885
US-20170095496-A1 GALACTOSIDE INHIBITORS FOR NEW USES LGALS1, LGALS2, LGALS3 LGALS3 3/4885LGALS9 9/4885LGALS7; LGALS7B 10/4885
US-20070185039-A1 NOVEL GALACTOSIDE INHIBITORS OF GALECTINS LGALS3, LGALS1, LGALS2 LGALS3 1/4885LGALS9 8/4885LGALS7; LGALS7B 7/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.