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 | |
|---|---|---|---|---|
| SCHEMBL1257655 | 0.92 | — | — | |
| SCHEMBL232455 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL11905554 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL3750224 | 0.90 | — | — | |
| SCHEMBL9748785 | 0.87 | — | — | |
| SCHEMBL3253094 | 0.83 | — | — | |
| SCHEMBL13836292 | 0.81 | — | — | |
| SCHEMBL16878643 | 0.77 | — | — | |
| SCHEMBL14699785 | 0.77 | — | — | |
| SCHEMBL5422549 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0215650-B1 | SUBSTITUTED BRIDGED-DIAZABICYCLOALKYL QUINOLONE CARBOXYLIC ACIDS | PFIZER INC. (US) | 1992-01-29 | — | — | EP | disclosed |