⚠ 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 | |
|---|---|---|---|---|
| Boric Acid SCHEMBL28371465 | 0.89 | — | — | |
| Boric Acid SCHEMBL28340168 | 0.73 | — | — | |
| SCHEMBL1686020 | 0.72 | — | — | |
| SCHEMBL217063 | 0.71 | — | — | |
| Boric Acid SCHEMBL28546701 | 0.71 | — | — | |
| SCHEMBL27598869 | 0.71 | TSHR (0.33) | — | |
| Methane SCHEMBL29091758 | 0.69 | — | — | |
| Ammonia Solution, Strong SCHEMBL6162157 | 0.69 | — | — | |
| Bicarbonate SCHEMBL26136232 | 0.69 | CA1 (0.33) | — | |
| SCHEMBL26103895 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-108376799-A | The manufacturing method of nonaqueous electrolytic solution and nonaqueous electrolytic solution secondary battery | 丰田自动车株式会社 | 2018-08-07 | — | — | CN | disclosed |