⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9618467 | 0.87 | — | — | |
| SCHEMBL29493706 | 0.82 | — | — | |
| Fluoride Ion SCHEMBL30880442 | 0.82 | — | — | |
| SCHEMBL29961483 | 0.82 | — | — | |
| Fluoride Ion SCHEMBL151190 | 0.82 | — | — | |
| SCHEMBL31570208 | 0.82 | — | — | |
| SCHEMBL9082312 | 0.82 | — | — | |
| SCHEMBL42346 | 0.82 | — | — | |
| Fluoride Ion SCHEMBL31621647 | 0.82 | — | — | |
| SCHEMBL30549562 | 0.82 | — | — |
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-117995663-A | Method for regulating and controlling donor concentration of gallium oxide semiconductor material by anion doping | 中山大学 | 2024-05-07 | — | — | CN | disclosed |
| WO-2019075932-A1 | CO-PRODUCTION METHOD FOR 2,3,3,3-TETRAFLUOROPROPYLENE AND TRANS-1,3,3,3-TETRAFLUOROPROPYLENE | 浙江衢化氟化学有限公司 | 2019-04-25 | — | — | WO | disclosed |