⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25868701 | 0.83 | MAPT (0.30) | — | |
| SCHEMBL9738235 | 0.66 | HTT (0.41) | — | |
| SCHEMBL17727792 | 0.59 | — | — | |
| SCHEMBL20808356 | 0.58 | HTT (0.39) | — | |
| SCHEMBL13751671 | 0.57 | — | — | |
| SCHEMBL12393539 | 0.55 | — | — | |
| SCHEMBL27598341 | 0.53 | — | — | |
| SCHEMBL26806847 | 0.53 | ELANE (0.36) | — | |
| SCHEMBL26692444 | 0.53 | — | — | |
| SCHEMBL21898663 | 0.52 | — | — |
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-2023134691-A1 | HIGH-VOLTAGE ELECTROLYTE AND BATTERY CONTAINING ELECTROLYTE | 珠海冠宇电池股份有限公司 | 2023-07-20 | — | — | WO | disclosed |