⚠ 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 | |
|---|---|---|---|---|
| Sulfurous Acid SCHEMBL29016182 | 0.71 | CA1 (0.35) | — | |
| SCHEMBL29016158 | 0.67 | — | — | |
| SCHEMBL29016175 | 0.65 | — | — | |
| SCHEMBL29016160 | 0.64 | KDM4E (0.31) | — | |
| SCHEMBL29016154 | 0.58 | KDM4E (0.35) | — | |
| SCHEMBL29016169 | 0.57 | — | — | |
| SCHEMBL11087987 | 0.56 | ALDH1A1 (0.38) | — | |
| SCHEMBL778077 | 0.52 | CA1 (0.36) | — | |
| SCHEMBL16284920 | 0.51 | ALB (0.33) | — | |
| SCHEMBL223148 | 0.48 | MEN1 (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-115873017-A | Cyclic sulfite compound, electrolyte and lithium ion battery | 比亚迪股份有限公司 | 2023-03-31 | — | — | CN | claimed |
| CN-115873017-A | Cyclic sulfite compound, electrolyte and lithium ion battery | 比亚迪股份有限公司 | 2023-03-31 | — | — | CN | disclosed |