⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2870202 | 0.88 | — | — | |
| SCHEMBL12796554 | 0.65 | — | — | |
| Tetrafluoroethylene SCHEMBL27627342 | 0.59 | — | — | |
| SCHEMBL19508359 | 0.54 | — | — | |
| SCHEMBL12796551 | 0.52 | — | — | |
| SCHEMBL18591331 | 0.52 | — | — | |
| SCHEMBL15116990 | 0.51 | — | — | |
| SCHEMBL3117258 | 0.50 | — | — | |
| O-Xylene SCHEMBL6398898 | 0.49 | TSHR (0.67) | — | |
| SCHEMBL13055491 | 0.49 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5080508-A | Perfluorovinyl ethers, cyclized | MITSUBISHI RAYON CO., LTD. (JP) | 1992-01-14 | — | — | US | disclosed |