⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29300142 | 0.88 | — | — | |
| SCHEMBL29300076 | 0.87 | CES1 (0.33) | — | |
| SCHEMBL25363544 | 0.87 | — | — | |
| SCHEMBL29300054 | 0.80 | APP (0.31) | — | |
| SCHEMBL29300068 | 0.79 | CES1 (0.30) | — | |
| SCHEMBL13169212 | 0.79 | — | — | |
| SCHEMBL10048351 | 0.78 | MEN1 (0.52) | — | |
| SCHEMBL16941742 | 0.77 | HSD17B10 (0.32) | — | |
| SCHEMBL29300053 | 0.77 | ALDH1A1 (0.38) | — | |
| SCHEMBL29300093 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024145810-A1 | ELECTROLYTE SOLUTION, SECONDARY BATTERY COMPRISING SAME, AND ELECTRIC DEVICE | 宁德时代新能源科技股份有限公司 | 2024-07-11 | — | — | WO | disclosed |