SCHEMBL2434419

SCHEMBL2434419

CCCCCCCCCOc1cc(OCc2ccccc2)cc(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)c4cc(OCCCCCCCCC)cc(OCc5ccccc5)c4)[C@H]3O)[C@@H]2O)c1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 11/20 0.62
LGALS9 O00182 7/20 0.62
LGALS7; LGALS7B P47929 7/20 0.62
LGALS8 O00214 4/20 0.62
LGALS1 P09382 7/20 0.59
PLA2G2A P14555 1/20 0.40
ALDH1A1 P00352 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SMPD1 P17405 2/20 0.38
HK1 P19367 1/20 0.38
HK2 P52789 1/20 0.38

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
SCHEMBL2434415 1.00 LGALS3 (0.62) LGALS3LGALS9LGALS7; LGALS7BLGALS8LGALS1
SCHEMBL2432865 0.92 LGALS3 (0.69) LGALS3LGALS9LGALS7; LGALS7BLGALS8LGALS1
SCHEMBL2432867 0.92 LGALS3 (0.69) LGALS3LGALS9LGALS7; LGALS7BLGALS8LGALS1
SCHEMBL2429467 0.90 LGALS3 (0.78) LGALS3LGALS9LGALS7; LGALS7BLGALS8LGALS1
SCHEMBL2429465 0.90 LGALS3 (0.78) LGALS3LGALS9LGALS7; LGALS7BLGALS8LGALS1
SCHEMBL2432229 0.88 LGALS3 (0.66) LGALS3LGALS9LGALS7; LGALS7BLGALS8LGALS1
SCHEMBL2432227 0.88 LGALS3 (0.66) LGALS3LGALS9LGALS7; LGALS7BLGALS8LGALS1
SCHEMBL2431042 0.88 LGALS3 (0.66) LGALS3LGALS9LGALS7; LGALS7BLGALS8LGALS1
SCHEMBL2431045 0.88 LGALS3 (0.66) LGALS3LGALS9LGALS7; LGALS7BLGALS8LGALS1
SCHEMBL2430456 0.87 LGALS3 (0.62) LGALS3LGALS9LGALS7; LGALS7BLGALS8LGALS1

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 5 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-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

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.