Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Lithium Ion. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ 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 Ion SCHEMBL28633571 | 0.97 | THRB (0.32) | — | |
| Lithium Ion SCHEMBL28624633 | 0.97 | THRB (0.32) | — | |
| Potassium Ion SCHEMBL28098100 | 0.95 | — | — | |
| Potassium Ion SCHEMBL28625220 | 0.92 | THRB (0.32) | — | |
| Potassium Ion SCHEMBL28369223 | 0.92 | THRB (0.32) | — | |
| Potassium Ion SCHEMBL29077858 | 0.92 | THRB (0.32) | — | |
| Potassium Ion SCHEMBL28150713 | 0.92 | THRB (0.32) | — | |
| SCHEMBL6410516 | 0.92 | CA2 (0.34) | — | |
| Lithium Ion SCHEMBL8450478 | 0.80 | — | — | |
| Lithium Ion SCHEMBL29040617 | 0.67 | — | — |
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-110994023-A | Lithium ion battery safety electrolyte, preparation method and application thereof, and lithium ion battery | 湖北宇电能源科技股份有限公司 | 2020-04-10 | — | — | CN | claimed |
| CN-110994023-A | Lithium ion battery safety electrolyte, preparation method and application thereof, and lithium ion battery | 湖北宇电能源科技股份有限公司 | 2020-04-10 | — | — | CN | disclosed |