⚠ 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 SCHEMBL460876 | 0.91 | — | — | |
| Vinyl Ether SCHEMBL8922463 | 0.85 | — | — | |
| Vinyl Ether SCHEMBL8919317 | 0.84 | — | — | |
| Vinyl Ether SCHEMBL10729825 | 0.79 | TSHR (0.50) | — | |
| Vinyl Ether SCHEMBL29022191 | 0.77 | MEN1 (0.30) | — | |
| Vinyl Ether SCHEMBL29022192 | 0.77 | — | — | |
| Vinyl Ether SCHEMBL29257005 | 0.74 | — | — | |
| Vinyl Ether SCHEMBL11267066 | 0.74 | TSHR (0.44) | — | |
| Vinyl Ether SCHEMBL11267069 | 0.74 | — | — | |
| SCHEMBL8637544 | 0.73 | CA1 (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5595676-A | TETRAFLUOROETHYLENE-SULFONATE SUBSTITUTED FLUOROALKYL VINYL ETHER COPOLYMER, MEMBRANE FOR FUEL CELLS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1997-01-21 | — | — | US | disclosed |
| WO-1994003503-A2 | FLUORINATED POLYMERS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1994-02-17 | — | — | WO | disclosed |