⚠ 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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL28830590 | 0.89 | — | — | |
| SCHEMBL1548514 | 0.86 | — | — | |
| Methane SCHEMBL28897899 | 0.82 | — | — | |
| Ethane SCHEMBL28445692 | 0.79 | TSHR (0.47) | — | |
| Ethylene SCHEMBL4466749 | 0.79 | — | — | |
| Phosphoric Acid SCHEMBL28835857 | 0.78 | — | — | |
| Lithium Ion SCHEMBL28830673 | 0.78 | — | — | |
| Potassium Ion SCHEMBL30060171 | 0.78 | — | — | |
| Oxalic Acid SCHEMBL29067657 | 0.78 | — | — | |
| Oxalic Acid SCHEMBL28830645 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115010730-A | Oxalato borate derivative, preparation method thereof, electrolyte and secondary battery | 恒大新能源技术(深圳)有限公司 | 2022-09-06 | — | — | CN | claimed |
| CN-115332634-A | Oxalic acid borate and preparation method and application thereof | 恒大新能源技术(深圳)有限公司 | 2022-11-11 | — | — | CN | disclosed |
| CN-115010730-A | Oxalato borate derivative, preparation method thereof, electrolyte and secondary battery | 恒大新能源技术(深圳)有限公司 | 2022-09-06 | — | — | CN | disclosed |
| CN-115010758-A | Bisphthalic acid phosphate derivative, preparation method thereof, electrolyte and secondary battery | 恒大新能源技术(深圳)有限公司 | 2022-09-06 | — | — | CN | disclosed |