SCHEMBL10067759

SCHEMBL10067759

OCC1O[C@@H](S[C@@H]2CCCC(n3cc(-c4ccccc4F)nn3)C2O)C(O)C(n2cc(-c3ccccc3F)nn2)[C@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 20/20 1.00
LGALS1 P09382 13/20 1.00
LGALS8 O00214 1/20 0.56

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
SCHEMBL9949428 1.00 LGALS3 (1.00) LGALS3LGALS1LGALS8
SCHEMBL9949434 1.00 LGALS3 (1.00) LGALS3LGALS1LGALS8
SCHEMBL10036913 1.00 LGALS3 (1.00) LGALS3LGALS1LGALS8
SCHEMBL19597976 1.00 LGALS3 (1.00) LGALS3LGALS1LGALS8
SCHEMBL15883860 1.00 LGALS3 (1.00) LGALS3LGALS1LGALS8
SCHEMBL19597975 0.91 LGALS3 (0.84) LGALS3LGALS1LGALS8
SCHEMBL1955106 0.88 LGALS3 (0.83) LGALS3LGALS1LGALS8
SCHEMBL1955104 0.88 LGALS3 (0.83) LGALS3LGALS1LGALS8
SCHEMBL9949889 0.86 LGALS3 (1.00) LGALS3LGALS1LGALS8
SCHEMBL9949892 0.86 LGALS3 (1.00) LGALS3LGALS1LGALS8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120165277-A1 NOVEL GALACTOSIDE INHIBITORS OF GALECTINS FORSKARPATENT I SYD AB (SE) 2012-06-28 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 (1 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-20120165277-A1 NOVEL GALACTOSIDE INHIBITORS OF GALECTINS LGALS1, LGALS3, LGALS2 LGALS3 2/4885LGALS1 1/4885LGALS8 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.