⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5146923 | 0.87 | — | — | |
| Potassium SCHEMBL31364531 | 0.75 | — | — | |
| SCHEMBL435119 | 0.75 | — | — | |
| SCHEMBL8718288 | 0.75 | — | — | |
| SCHEMBL9225917 | 0.67 | — | — | |
| SCHEMBL4540138 | 0.67 | — | — | |
| SCHEMBL1096219 | 0.67 | — | — | |
| Hydrogen Peroxide SCHEMBL442044 | 0.58 | — | — | |
| Hydrogen Peroxide SCHEMBL10736567 | 0.58 | CA1 (0.33) | — | |
| SCHEMBL522701 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-2000149950-A | NONAQUEOUS ELECTROLYTE SECONDARY BATTERY | JAPAN STORAGE BATTERY CO LTD | 2000-05-30 | — | — | JP | disclosed |