⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22211129 | 0.78 | — | — | |
| SCHEMBL22251939 | 0.78 | — | — | |
| SCHEMBL14493147 | 0.77 | — | — | |
| SCHEMBL4286711 | 0.75 | TNKS (0.37) | — | |
| SCHEMBL5534466 | 0.72 | — | — | |
| SCHEMBL14945042 | 0.71 | CYP1A2 (0.30) | — | |
| SCHEMBL14244544 | 0.69 | — | — | |
| SCHEMBL2364962 | 0.68 | — | — | |
| SCHEMBL18499830 | 0.66 | — | — | |
| SCHEMBL13996172 | 0.66 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-113410516-A | Organic silicon electrolyte and preparation method and application thereof | 清远萨菲安新材料有限公司 | 2021-09-17 | — | — | CN | disclosed |