⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9161224 | 0.73 | — | — | |
| SCHEMBL27275730 | 0.67 | LMNA (0.32) | — | |
| SCHEMBL27259949 | 0.64 | — | — | |
| SCHEMBL27260136 | 0.64 | — | — | |
| SCHEMBL18834743 | 0.64 | — | — | |
| SCHEMBL27272042 | 0.61 | — | — | |
| 1,5-Pentanediol SCHEMBL15552828 | 0.60 | TSHR (0.57) | — | |
| 1,6-Hexanediol SCHEMBL28123126 | 0.57 | TSHR (0.53) | — | |
| SCHEMBL25302278 | 0.57 | TSHR (0.61) | — | |
| SCHEMBL21462773 | 0.57 | TSHR (0.61) | — |
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-119192678-A | Environment-friendly stabilizer with rust-proof function | 广东尚诺新材料科技有限公司 | 2024-12-27 | — | — | CN | disclosed |