⚠ 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 | |
|---|---|---|---|---|
| Lithium SCHEMBL29851493 | 1.00 | — | — | |
| Lithium SCHEMBL29374357 | 1.00 | — | — | |
| Lithium SCHEMBL31287260 | 0.82 | — | — | |
| Lithium SCHEMBL1050446 | 0.82 | — | — | |
| Lithium SCHEMBL31325855 | 0.82 | — | — | |
| Potassium SCHEMBL31237132 | 0.82 | — | — | |
| Lithium SCHEMBL31411151 | 0.82 | — | — | |
| Lithium SCHEMBL31287280 | 0.82 | — | — | |
| Lithium SCHEMBL32679838 | 0.82 | — | — | |
| Lithium SCHEMBL31287262 | 0.82 | — | — |
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-116005055-B | Thermal battery anode lithium boron material and preparation method thereof | 北京有色金属与稀土应用研究所有限公司 | 2024-04-30 | — | — | CN | disclosed |
| CN-116005055-A | Thermal battery anode lithium boron material and preparation method thereof | 北京有色金属与稀土应用研究所有限公司 | 2023-04-25 | — | — | CN | disclosed |