⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1849 | 0.79 | — | — | |
| SCHEMBL10636466 | 0.79 | — | — | |
| SCHEMBL27466495 | 0.79 | ALDH1A1 (1.00) | — | |
| SCHEMBL4390490 | 0.79 | ALDH1A1 (1.00) | — | |
| SCHEMBL5708629 | 0.77 | — | — | |
| SCHEMBL20681605 | 0.77 | — | — | |
| Hydrogen Peroxide SCHEMBL9143793 | 0.77 | — | — | |
| SCHEMBL21340366 | 0.77 | — | — | |
| Ethylene SCHEMBL44117 | 0.77 | — | — | |
| Fluoride SCHEMBL5607591 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0467935-A1 | TRANSPARENT THERMOPLASTIC MOULDING MATERIAL CONSISTING OF ESTERS OF 2,3-DIFLUORACRYLIC ACID. | HOECHST AG (DE) | 1992-01-29 | — | — | EP | disclosed |
| EP-0363797-A2 | Thermoplastic moulding compositions based on polycarbonate, grafted rubbers and N-substituted methacryl amide copolymers | BASF Aktiengesellschaft (DE) | 1990-04-18 | — | — | EP | disclosed |