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 SCHEMBL11053322 | 0.95 | — | — | |
| Lithium Ion SCHEMBL30576673 | 0.95 | — | — | |
| Lithium Ion SCHEMBL1961 | 0.95 | — | — | |
| Potassium Ion SCHEMBL4999362 | 0.90 | — | — | |
| Lithium Ion SCHEMBL6829441 | 0.90 | — | — | |
| Lithium Ion SCHEMBL4999640 | 0.90 | — | — | |
| Lithium Ion SCHEMBL8602755 | 0.90 | — | — | |
| Iodomethane SCHEMBL7699034 | 0.86 | ALDH1A1 (0.31) | — | |
| SCHEMBL7949043 | 0.84 | — | — | |
| SCHEMBL3176524 | 0.84 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3983400-A1 | QUINAZOLINYL COMPOUNDS AND METHODS OF USE | Genentech, Inc. (US) | 2022-04-20 | — | — | EP | disclosed |
| WO-2020252165-A1 | QUINAZOLINYL COMPOUNDS AND METHODS OF USE | GENENTECH, INC. (US) | 2020-12-17 | — | — | WO | disclosed |
| US-6951944-B2 | Production of imidazole derivatives and novel intermediates of the derivatives | AZWELL INC. (JP) | 2005-10-04 | — | — | US | disclosed |
| US-20050043277-A1 | Production of imidazole derivatives and novel intermediates of the derivatives | AZWELL INC. (JP) | 2005-02-24 | — | — | US | disclosed |
| EP-0719769-A2 | Process for preparing aminoepoxydes from amino acid esters via amino-halomethyl-ketones | Bristol-Myers Squibb Company (US) | 1996-07-03 | — | — | EP | disclosed |
| US-5481011-A | PREPARING AMINOEPOXIDES BY REACTING N-CARBARALKOXY OR N-CARBALKOXY AMINO ACID ESTER WITH DIHALOMETHYLLITHIUM TO FORM HALOMETHYL KETONE AND CONVERTING KETONE TO EPOXIDE | BRISTOL-MYERS SQUIBB COMPANY (US) | 1996-01-02 | — | — | US | disclosed |