⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2990882 | 0.75 | — | — | |
| SCHEMBL8961231 | 0.63 | ALDH1A1 (0.30) | — | |
| SCHEMBL19628666 | 0.63 | KDM4E (0.33) | — | |
| SCHEMBL24200566 | 0.62 | — | — | |
| SCHEMBL18430746 | 0.62 | — | — | |
| SCHEMBL12918661 | 0.61 | ALDH1A1 (0.41) | — | |
| SCHEMBL21887494 | 0.60 | CHRNB2 (0.30) | — | |
| SCHEMBL21981258 | 0.60 | APP (0.31) | — | |
| SCHEMBL10452360 | 0.60 | LIPA (0.39) | — | |
| SCHEMBL6814313 | 0.60 | LIPA (0.39) | — |
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-4213244-A1 | SODIUM ION POSITIVE ELECTRODE MATERIAL AND PREPARATION METHOD THEREFOR, AND SODIUM ION BATTERY | Hengdian Group DMEGC Magnetics Co., Ltd. (CN) | 2023-07-19 | — | — | EP | disclosed |