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 | |
|---|---|---|---|---|
| SCHEMBL863743 | 0.93 | TSHR (0.38) | — | |
| Potassium Ion SCHEMBL5342292 | 0.93 | — | — | |
| SCHEMBL5350753 | 0.93 | — | — | |
| SCHEMBL6297498 | 0.87 | TSHR (0.33) | — | |
| SCHEMBL57088 | 0.71 | — | — | |
| Ammonia Solution, Strong SCHEMBL8081457 | 0.68 | — | — | |
| Lithium Ion SCHEMBL4301067 | 0.68 | — | — | |
| Ammonia Solution, Strong SCHEMBL11315539 | 0.68 | — | — | |
| SCHEMBL8359826 | 0.68 | TSHR (0.50) | — | |
| SCHEMBL10794688 | 0.65 | TSHR (0.46) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1967531-A1 | Method of making alkoxy functionalized rubbery polymers | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 2008-09-10 | — | — | EP | disclosed |
| US-7335706-B1 | Method of making alkoxy functionalized rubbery polymers | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 2008-02-26 | — | — | US | disclosed |
| US-7291687-B1 | Catalyst system for synthesizing rubbery polymers having a high trans microstructure content | THE GOODYEAR TIRE AND RUBBER COMPANY (US) | 2007-11-06 | — | — | US | disclosed |