⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3730546 | 0.77 | — | — | |
| SCHEMBL28997082 | 0.75 | CHRNB2 (0.35) | — | |
| SCHEMBL29143228 | 0.74 | CA1 (0.33) | — | |
| SCHEMBL13737389 | 0.74 | CA1 (0.33) | — | |
| SCHEMBL3730935 | 0.74 | — | — | |
| SCHEMBL2783520 | 0.73 | CA1 (0.36) | — | |
| SCHEMBL6769883 | 0.73 | CA1 (0.36) | — | |
| SCHEMBL20652478 | 0.71 | — | — | |
| SCHEMBL25148822 | 0.70 | ACHE (0.31) | — | |
| SCHEMBL28986605 | 0.70 | SLC6A2 (0.31) | — |
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-118156613-A | Electrolyte additive for lithium ion or sodium ion secondary battery and application thereof | 北京大学深圳研究生院 | 2024-06-07 | — | — | CN | claimed |
| CN-115692852-A | Imidazole structure-containing electrolyte additive, electrolyte and lithium ion battery | 中节能万润股份有限公司 | 2023-02-03 | — | — | CN | claimed |
| CN-118156613-A | Electrolyte additive for lithium ion or sodium ion secondary battery and application thereof | 北京大学深圳研究生院 | 2024-06-07 | — | — | CN | disclosed |
| CN-115692852-A | Imidazole structure-containing electrolyte additive, electrolyte and lithium ion battery | 中节能万润股份有限公司 | 2023-02-03 | — | — | CN | disclosed |