⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4443032 | 0.80 | RAF1 (0.31) | — | |
| SCHEMBL31570222 | 0.79 | APP (0.34) | — | |
| SCHEMBL2934860 | 0.79 | APP (0.34) | — | |
| SCHEMBL28639792 | 0.79 | MET (0.31) | — | |
| SCHEMBL28093559 | 0.74 | MET (0.32) | — | |
| SCHEMBL28077414 | 0.73 | HPGD (0.32) | — | |
| SCHEMBL28489734 | 0.70 | KAT8 (0.41) | — | |
| SCHEMBL25184746 | 0.69 | POLB (0.33) | — | |
| SCHEMBL28644704 | 0.67 | GAA (0.33) | — | |
| SCHEMBL30038851 | 0.67 | NPC1 (0.33) | — |
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-115427501-A | Fluororesin composition, cured coating film, laminated film, and structure | 中国涂料株式会社 | 2022-12-02 | — | — | CN | disclosed |