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 | |
|---|---|---|---|---|
| SCHEMBL8759409 | 0.68 | — | — | |
| SCHEMBL7791679 | 0.65 | — | — | |
| SCHEMBL676033 | 0.64 | — | — | |
| SCHEMBL4606137 | 0.62 | — | — | |
| Lithium Ion SCHEMBL10869969 | 0.56 | — | — | |
| SCHEMBL919271 | 0.51 | — | — | |
| SCHEMBL7625427 | 0.50 | — | — | |
| SCHEMBL21679576 | 0.48 | — | — | |
| SCHEMBL9278578 | 0.48 | — | — | |
| SCHEMBL397567 | 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-1237986-A1 | NEW CYCLOTRISILOXANES, NEW SILOXANE POLYMERS AND THEIR PREPARATION | UNIVERSITY OF SOUTHERN CALIFORNIA (US) | 2002-09-11 | — | — | EP | disclosed |
| US-6284906-B1 | ANIONIC POLYMERIZATION OF A CYCLOTRISILOXANE HAVING THE FUNCTIONAL GROUP SI--OH; PREPARATION OF LINEAR SILOXANE POLYMERS BY CATIONIC OR ANIONIC POLYMERIZATION OF A CYCLOTRISILOXANE HAVING A VINYLTERMINATED FUNCTIONAL GROUP. | UNIVERSITY OF SOUTHERN CALIFORNIA | 2001-09-04 | — | — | US | disclosed |
| WO-2001027187-A1 | NEW CYCLOTRISILOXANES, NEW SILOXANE POLYMERS AND THEIR PREPARATION | UNIVERSITY OF SOUTHERN CALIFORNIA (US) | 2001-04-19 | — | — | WO | disclosed |