⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26437578 | 0.70 | — | — | |
| SCHEMBL678720 | 0.70 | — | — | |
| SCHEMBL22688175 | 0.70 | ALDH1A1 (0.31) | — | |
| SCHEMBL29733039 | 0.69 | MEN1 (0.33) | — | |
| SCHEMBL2550342 | 0.69 | — | — | |
| SCHEMBL26437446 | 0.67 | — | — | |
| SCHEMBL29042034 | 0.67 | — | — | |
| SCHEMBL21142355 | 0.67 | POLB (0.30) | — | |
| SCHEMBL24336864 | 0.65 | MEN1 (0.31) | — | |
| SCHEMBL21901233 | 0.65 | TDP1 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-4175001-A1 | NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTIC SOLUTION BATTERY | Mitsubishi Chemical Corporation (JP) | 2023-05-03 | — | — | EP | disclosed |