⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28014 | 0.94 | ALDH1A1 (0.30) | — | |
| SCHEMBL4826014 | 0.89 | — | — | |
| SCHEMBL29561426 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL1554658 | 0.89 | — | — | |
| Fluoride SCHEMBL1399379 | 0.89 | — | — | |
| Water SCHEMBL533765 | 0.89 | — | — | |
| Water SCHEMBL15666534 | 0.89 | — | — | |
| SCHEMBL1143571 | 0.89 | — | — | |
| Ethyne SCHEMBL20610034 | 0.84 | — | — | |
| SCHEMBL6045462 | 0.80 | — | — |
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-9118062-B2 | Anode and method of manufacturing the same, and battery and method of manufacturing the same | SONY CORPORATION (JP) | 2015-08-25 | — | — | US | disclosed |
| US-20080311472-A1 | ANODE AND METHOD OF MANUFACTURING THE SAME, AND BATTERY AND METHOD OF MANUFACTURING THE SAME | SONY CORPORATION (JP) | 2008-12-18 | — | — | US | disclosed |