⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL354570 | 0.81 | — | — | |
| SCHEMBL27345199 | 0.72 | — | — | |
| SCHEMBL19588707 | 0.72 | — | — | |
| SCHEMBL30220446 | 0.69 | — | — | |
| SCHEMBL4264516 | 0.69 | — | — | |
| SCHEMBL14446385 | 0.67 | — | — | |
| SCHEMBL14446386 | 0.67 | — | — | |
| SCHEMBL14446346 | 0.67 | — | — | |
| SCHEMBL2049566 | 0.67 | — | — | |
| SCHEMBL31680341 | 0.67 | — | — |
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-117105750-A | Synthesis method of hydrofluoroether | 河南省氟基新材料科技有限公司 | 2023-11-24 | — | — | CN | disclosed |