SCHEMBL13381106

SCHEMBL13381106

CCC1(C(=O)OC)O[C@@H](O[C@@H]2C(CO[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)O[C@@H](O[C@H]3C(OC)[C@H]4OCC3(C(=O)OC)O[C@H]4O[C@@H]3C(CO[Si](c4ccccc4)(c4ccccc4)C(C)(C)C)O[C@H](OC)C(O)[C@H]3OC)C(O)[C@H]2O)C(OC)[C@@H](OC)[C@@H]1O[C@@H]1CC(CO)[C@@H](OC)[C@H](OC)C1OC

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ LGALS9 O00182 1/20 0.31
▸ LGALS1 P09382 1/20 0.31
▸ LGALS3 P17931 1/20 0.31
▸ LGALS7; LGALS7B P47929 1/20 0.31

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
SCHEMBL13381107 0.75 SERPINC1 (0.30) —
SCHEMBL13381078 0.72 LGALS8 (0.35) LGALS9LGALS1LGALS3LGALS7; LGALS7B
SCHEMBL13381029 0.71 PTPN1 (0.33) —
SCHEMBL13381015 0.69 PTPN1 (0.37) —
SCHEMBL13381027 0.68 PTPN1 (0.33) —
SCHEMBL13381075 0.67 CA1 (0.37) —
SCHEMBL13381069 0.65 TNF (0.35) —
SCHEMBL13381064 0.65 NT5E (0.36) —
SCHEMBL13381081 0.65 PTPN1 (0.38) —
SCHEMBL12174017 0.64 LGALS8 (0.40) LGALS9LGALS3

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-20100081708-A1 ANTICOAGULANT COMPOUNDS ENDOTIS PHARMA (FR) 2010-04-01 — — 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-20100081708-A1 ANTICOAGULANT COMPOUNDS SERPINC1, F2, FUT5 LGALS9 177/4885LGALS1 195/4885LGALS3 157/4885

“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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