SCHEMBL3278577

SCHEMBL3278577

COC(=O)c1cn([C@H]2[C@@H](O)[C@@H](CO)O[C@@H](SC)[C@@H]2O)nn1

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 20/20 0.66
LGALS9 O00182 8/20 0.66
LGALS8 O00214 7/20 0.66
LGALS7; LGALS7B P47929 7/20 0.66
LGALS1 P09382 6/20 0.59

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
SCHEMBL17414602 1.00 LGALS3 (0.66) LGALS3LGALS9LGALS8LGALS7; LGALS7BLGALS1
SCHEMBL13385529 1.00 LGALS3 (0.66) LGALS3LGALS9LGALS8LGALS7; LGALS7BLGALS1
SCHEMBL13404799 1.00 LGALS3 (0.66) LGALS3LGALS9LGALS8LGALS7; LGALS7BLGALS1
SCHEMBL16258753 1.00 LGALS3 (0.66) LGALS3LGALS9LGALS8LGALS7; LGALS7BLGALS1
SCHEMBL16258793 0.87 LGALS3 (0.86) LGALS3LGALS9LGALS8LGALS7; LGALS7BLGALS1
SCHEMBL13404617 0.87 LGALS3 (0.86) LGALS3LGALS9LGALS8LGALS7; LGALS7BLGALS1
SCHEMBL3276985 0.87 LGALS3 (0.86) LGALS3LGALS9LGALS8LGALS7; LGALS7BLGALS1
SCHEMBL13385533 0.87 LGALS3 (0.86) LGALS3LGALS9LGALS8LGALS7; LGALS7BLGALS1
SCHEMBL13405067 0.83 LGALS3 (0.77) LGALS3LGALS9LGALS8LGALS7; LGALS7BLGALS1
SCHEMBL3277187 0.83 LGALS3 (0.77) LGALS3LGALS9LGALS8LGALS7; LGALS7BLGALS1

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 6 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
US-20070185041-A1 NOVEL 3-TRIAZOLYL-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
US-7700763-B2 3-triazolyl-galactoside inhibitors of galectins FORSKARPATENT I SYD AB (SE) 2010-04-20 US disclosed
US-20070185041-A1 NOVEL 3-TRIAZOLYL-GALACTOSIDE INHIBITORS OF GALECTINS GALECTO BIOTECH AB (SE) 2007-08-09 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 7/4885LGALS8 5/4885
US-20170095496-A1 GALACTOSIDE INHIBITORS FOR NEW USES LGALS1, LGALS2, LGALS3 LGALS3 3/4885LGALS9 9/4885LGALS8 5/4885
US-20070185041-A1 NOVEL 3-TRIAZOLYL-GALACTOSIDE INHIBITORS OF GALECTINS LGALS3, LGALS1, LGALS3BP LGALS3 1/4885LGALS9 7/4885LGALS8 6/4885

“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.