⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL3297030 | 0.87 | — | — | |
| SCHEMBL25290804 | 0.87 | — | — | |
| SCHEMBL7038262 | 0.82 | — | — | |
| SCHEMBL3185415 | 0.82 | — | — | |
| SCHEMBL21979551 | 0.82 | — | — | |
| SCHEMBL7040826 | 0.82 | — | — | |
| Trimethylammonium SCHEMBL9299889 | 0.79 | — | — | |
| SCHEMBL30005402 | 0.76 | PGD (0.34) | — | |
| SCHEMBL11751873 | 0.72 | — | — | |
| SCHEMBL28492638 | 0.72 | — | — |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1032579-B1 | CARBOHYDRATE DERIVATIVES | AKZO NOBEL NV (NL) | 2003-05-02 | — | — | EP | disclosed |
| US-6174863-B1 | PENTASACCHARIDE HAVING ONLY FOUR TO SIX SULFATE GROUPS FOR REDUCED SIDE EFFECTS; ANTITHROMBOTIC AGENTS, SMOOTH MUSCLE CELL ANTIPROLIFERATIVE AGENTS | AKZO NOBEL N.V. (NL) | 2001-01-16 | — | — | US | disclosed |
| EP-1032579-A1 | CARBOHYDRATE DERIVATIVES | Akzo Nobel N.V. (NL) | 2000-09-06 | — | — | EP | disclosed |
| WO-1999025720-A1 | CARBOHYDRATE DERIVATIVES | AKZO NOBEL N.V. (NL) | 1999-05-27 | — | — | WO | disclosed |