⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1162205 | 0.87 | — | — | |
| Zinc Ion SCHEMBL29765279 | 0.87 | — | — | |
| SCHEMBL29493159 | 0.87 | — | — | |
| SCHEMBL29927973 | 0.87 | — | — | |
| Zinc Ion SCHEMBL62307 | 0.87 | — | — | |
| Zinc Ion SCHEMBL503403 | 0.87 | — | — | |
| Zinc Ion SCHEMBL29616315 | 0.87 | — | — | |
| Zinc Ion SCHEMBL87535 | 0.75 | — | — | |
| Lithium Ion SCHEMBL4334566 | 0.75 | — | — | |
| SCHEMBL2786392 | 0.75 | — | — |
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-120058463-A | Application of chromium-based catalyst in preparation of perfluorobromooctane serving as fluorocarbon nano contrast key material by perfluoroiodooctane catalytic bromination | 湖南人文科技学院 | 2025-05-30 | — | — | CN | disclosed |