SCHEMBL23374332

SCHEMBL23374332

OCC[C@H]1O[C@@H](c2ncnn2-c2ccccc2)[C@H](O)[C@@H](n2cc(-c3cc(F)c(F)c(F)c3)nn2)[C@H]1O

nearest known ligand 0.88

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 20/20 0.88

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
SCHEMBL23374231 0.94 LGALS3 (0.88) LGALS3
SCHEMBL20868889 0.93 LGALS3 (1.00) LGALS3
SCHEMBL23374351 0.92 LGALS3 (0.89) LGALS3
SCHEMBL23374239 0.91 LGALS3 (0.89) LGALS3
SCHEMBL23374345 0.90 LGALS3 (0.89) LGALS3
SCHEMBL23374323 0.90 LGALS3 (0.88) LGALS3
SCHEMBL23374338 0.89 LGALS3 (0.89) LGALS3
SCHEMBL23374246 0.87 LGALS3 (1.00) LGALS3
SCHEMBL20935509 0.87 LGALS3 (1.00) LGALS3
SCHEMBL20935484 0.86 LGALS3 (1.00) LGALS3

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-20210147408-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 BRISTOL MYERS SQUIBB CO (US) 2021-05-20 — — 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-20210147408-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 LGALS3, LGALS1, LGALS3BP LGALS3 1/4885

“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.

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