SCHEMBL25855498

SCHEMBL25855498

CO[C@@H]1[C@@H](n2cc(-c3cccc(F)c3)nn2)[C@@H](O)[C@@H](CO)O[C@H]1C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 20/20 0.63
LGALS1 P09382 7/20 0.62
LGALS8 O00214 1/20 0.62
LGALS9 O00182 1/20 0.54

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
SCHEMBL30170947 0.91 LGALS3 (0.61) LGALS3LGALS1LGALS8LGALS9
SCHEMBL22542393 0.89 LGALS3 (0.72) LGALS3LGALS1LGALS8
SCHEMBL30170990 0.84 LGALS3 (0.59) LGALS3LGALS1LGALS8
SCHEMBL25226825 0.84 LGALS3 (0.59) LGALS3LGALS1LGALS8
SCHEMBL30171086 0.84 LGALS3 (0.59) LGALS3LGALS1LGALS8
SCHEMBL30170914 0.84 LGALS3 (0.57) LGALS3LGALS1LGALS8LGALS9
SCHEMBL25613277 0.84 LGALS3 (0.57) LGALS3LGALS1LGALS8
SCHEMBL25228388 0.84 LGALS3 (0.57) LGALS3LGALS1LGALS8LGALS9
SCHEMBL30242097 0.84 LGALS3 (0.57) LGALS3LGALS1LGALS8LGALS9
SCHEMBL24420887 0.84 LGALS3 (0.53) LGALS3LGALS1LGALS8LGALS9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230212158-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 BRISTOL MYERS SQUIBB CO (US) 2023-07-06 US disclosed
US-20230212158-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 BRISTOL MYERS SQUIBB CO (US) 2023-07-06 US disclosed
EP-4149939-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 Bristol-Myers Squibb Company (US) 2023-03-22 EP disclosed
CN-115551850-A Small molecule inhibitors of galectin-3 百时美施贵宝公司 2022-12-30 CN 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-20230212158-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 LGALS3, LGALS1, LGALS3BP LGALS3 1/4885LGALS1 2/4885LGALS8 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.