⚠ 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 | |
|---|---|---|---|---|
| Vinyl Ether SCHEMBL10316701 | 0.96 | — | — | |
| Cyclopentane SCHEMBL10594418 | 0.96 | — | — | |
| Cyclooctane SCHEMBL14762397 | 0.96 | — | — | |
| Vinyl Ether SCHEMBL2813781 | 0.96 | — | — | |
| Vinyl Ether SCHEMBL9243689 | 0.96 | — | — | |
| Cycloheptane SCHEMBL14761863 | 0.96 | — | — | |
| Vinyl Ether SCHEMBL3837080 | 0.96 | — | — | |
| Cyclohexane SCHEMBL657134 | 0.96 | — | — | |
| Vinyl Ether SCHEMBL2905334 | 0.85 | — | — | |
| Cyclohexane SCHEMBL3165687 | 0.85 | — | — |
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-109715744-B | Anti-biological adhesion coating | ＡＧＣ株式会社 | 2021-04-02 | — | — | CN | disclosed |