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 | |
|---|---|---|---|---|
| SCHEMBL9182759 | 0.94 | — | — | |
| Zinc Ion SCHEMBL8204153 | 0.94 | BBOX1 (0.56) | — | |
| Potassium Ion SCHEMBL11786546 | 0.94 | — | — | |
| SCHEMBL9512763 | 0.79 | CES2 (0.42) | — | |
| Potassium Ion SCHEMBL31493851 | 0.79 | CA1 (0.48) | — | |
| Lithium Ion SCHEMBL28696559 | 0.74 | BBOX1 (0.54) | — | |
| SCHEMBL9233585 | 0.73 | MAPT (0.42) | — | |
| SCHEMBL4866346 | 0.72 | OR51E2 (0.46) | — | |
| Succinic Acid SCHEMBL107349 | 0.71 | FFAR3 (0.56) | — | |
| SCHEMBL519505 | 0.71 | — | — |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113966350-A | Modified vinyl aromatic copolymer and method for producing same, modified conjugated diene copolymer obtained therefrom, composition of modified conjugated diene copolymer, crosslinked rubber, and tire member | 日铁化学材料株式会社 | 2022-01-21 | — | — | CN | disclosed |