⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28439945 | 0.94 | — | — | |
| SCHEMBL28100474 | 0.94 | — | — | |
| SCHEMBL29043262 | 0.94 | — | — | |
| SCHEMBL29290401 | 0.94 | — | — | |
| SCHEMBL29043257 | 0.89 | — | — | |
| SCHEMBL29140501 | 0.89 | — | — | |
| SCHEMBL29223929 | 0.89 | — | — | |
| Water SCHEMBL864487 | 0.88 | CA1 (0.30) | — | |
| SCHEMBL9456097 | 0.88 | — | — | |
| SCHEMBL9222775 | 0.88 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117059797-A | Prussian blue positive electrode material, preparation method and application thereof | 湖州超钠新能源科技有限公司 | 2023-11-14 | — | — | CN | disclosed |
| CN-116525795-A | Prussian blue sodium ion battery positive electrode material, preparation method and sodium battery | 湖州超钠新能源科技有限公司 | 2023-08-01 | — | — | CN | disclosed |