⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4855483 | 0.76 | ALDH1A1 (0.30) | — | |
| SCHEMBL4851252 | 0.76 | ALDH1A1 (0.30) | — | |
| SCHEMBL560773 | 0.75 | — | — | |
| SCHEMBL6113519 | 0.75 | — | — | |
| SCHEMBL19397 | 0.72 | — | — | |
| SCHEMBL245872 | 0.72 | — | — | |
| SCHEMBL132463 | 0.72 | — | — | |
| SCHEMBL28616807 | 0.72 | — | — | |
| SCHEMBL1962768 | 0.72 | ALDH1A1 (0.38) | — | |
| SCHEMBL1145086 | 0.72 | — | — |
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-7414148-B2 | Process for producing alkoxycarbonylfluoroalkanesulfonates | CENTRAL GLASS COMPANY LIMITED (JP) | 2008-08-19 | — | — | US | disclosed |
| US-20080108846-A1 | PROCESS FOR PRODUCING ALKOXYCARBONYLFLUOROALKANESULFONATES | CENTRAL GLASS COMPANY, LIMITED (JP) | 2008-05-08 | — | — | US | disclosed |