⚠ 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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL29259634 | 0.89 | — | — | |
| SCHEMBL15157264 | 0.87 | — | — | |
| SCHEMBL1875275 | 0.87 | — | — | |
| Fluoride SCHEMBL875509 | 0.87 | — | — | |
| Fluoride SCHEMBL9861901 | 0.87 | — | — | |
| Fluoride SCHEMBL25287655 | 0.87 | — | — | |
| Fluoride SCHEMBL9660258 | 0.87 | — | — | |
| SCHEMBL1178591 | 0.87 | — | — | |
| SCHEMBL8353125 | 0.87 | — | — | |
| Fluoride SCHEMBL28272743 | 0.87 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117128062-B | Water-free cooling power generation system and control method thereof | 中国核动力研究设计院 | 2024-03-26 | — | — | CN | disclosed |
| CN-117128062-A | Water-free cooling power generation system and control method thereof | 中国核动力研究设计院 | 2023-11-28 | — | — | CN | disclosed |