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 | |
|---|---|---|---|---|
| SCHEMBL6562883 | 0.92 | CA1 (0.33) | — | |
| SCHEMBL27946658 | 0.92 | — | — | |
| Potassium Ion SCHEMBL10820786 | 0.92 | — | — | |
| Zinc Ion SCHEMBL10524323 | 0.88 | CA1 (0.31) | — | |
| Lithium Ion SCHEMBL443258 | 0.70 | — | — | |
| Lithium Ion SCHEMBL7096326 | 0.70 | — | — | |
| Lithium Ion SCHEMBL29184204 | 0.70 | — | — | |
| Lithium Ion SCHEMBL6352034 | 0.67 | — | — | |
| Lithium Ion SCHEMBL29249315 | 0.67 | — | — | |
| Lithium Ion SCHEMBL9249821 | 0.67 | CA1 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7828879-B2 | lithium titanate comprising 70 mol % or more of Li4TiO4 and 30 mol % or less of Li2TiO3; carbon dioxide sequestration; global warming | CHUO UNIVERSITY (JP) | 2010-11-09 | — | — | US | disclosed |
| US-20090107334-A1 | lithium titanate comprising 70 mol % or more of Li4TiO4 and 30 mol % or less of Li2TiO3; carbon dioxide sequestration; global warming | CHUO UNIVERSITY (JP) | 2009-04-30 | — | — | US | disclosed |