⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16370918 | 0.96 | LMNA (0.42) | — | |
| SCHEMBL16821 | 0.96 | — | — | |
| SCHEMBL18906335 | 0.96 | — | — | |
| Water SCHEMBL29184009 | 0.92 | LMNA (0.39) | — | |
| Methyl Alcohol SCHEMBL28633344 | 0.92 | — | — | |
| SCHEMBL11799633 | 0.92 | — | — | |
| Water SCHEMBL542920 | 0.92 | — | — | |
| Acetic Acid SCHEMBL31314449 | 0.88 | FFAR3 (0.54) | — | |
| SCHEMBL28791559 | 0.88 | LMNA (0.36) | — | |
| Hydrochloric Acid SCHEMBL9811400 | 0.88 | — | — |
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-114555576-A | Method for producing perfluoro (2, 4-dimethyl-2-fluoroformyl-1, 3-dioxolane) | 公益财团法人相模中央化学研究所 | 2022-05-27 | — | — | CN | disclosed |