⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10763396 | 0.53 | — | — | |
| SCHEMBL4947415 | 0.46 | — | — | |
| SCHEMBL14353388 | 0.43 | — | — | |
| SCHEMBL21980970 | 0.41 | — | — | |
| SCHEMBL26520011 | 0.40 | — | — | |
| Methane SCHEMBL4814579 | 0.40 | — | — | |
| SCHEMBL13136002 | 0.40 | TSHR (0.33) | — | |
| SCHEMBL18748729 | 0.38 | ALDH1A1 (0.44) | — | |
| SCHEMBL22448096 | 0.38 | — | — | |
| SCHEMBL24052367 | 0.38 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230238578-A1 | ELECTROLYTE FOR LITHIUM SECONDARY BATTERY AND LITHIUM SECONDARY BATTERY COMPRISING SAME | SAMSUNG SDI CO., LTD. (KR) | 2023-07-27 | — | — | US | disclosed |