⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10840951 | 0.95 | — | — | |
| SCHEMBL10840569 | 0.93 | — | — | |
| SCHEMBL500083 | 0.86 | ALDH1A1 (0.31) | — | |
| SCHEMBL1218499 | 0.85 | ALDH1A1 (0.36) | — | |
| SCHEMBL5693985 | 0.85 | ALDH1A1 (0.36) | — | |
| SCHEMBL5704689 | 0.85 | ALDH1A1 (0.36) | — | |
| SCHEMBL15357312 | 0.85 | ALDH1A1 (0.30) | — | |
| SCHEMBL30869793 | 0.84 | ALDH1A1 (0.32) | — | |
| SCHEMBL8466277 | 0.83 | ALDH1A1 (0.31) | — | |
| SCHEMBL8468136 | 0.83 | ALDH1A1 (0.31) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4594458-A | Vinyl ether monomers derived from alkyl perfluoro-ω-(2-iodoethoxy) compounds | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1986-06-10 | — | — | US | disclosed |
| US-4531011-A | Alkyl perfluoro-omega-(2-iodoethoxy) compounds and vinyl ethers therefrom | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1985-07-23 | — | — | US | disclosed |
| EP-0121330-A1 | Alkyl perfluoro-omega-(2-iodoethoxy) compounds and vinyl ethers therefrom | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1984-10-10 | — | — | EP | disclosed |