⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9155445 | 0.80 | — | — | |
| SCHEMBL8675297 | 0.80 | — | — | |
| SCHEMBL10521326 | 0.80 | — | — | |
| SCHEMBL28552127 | 0.80 | — | — | |
| SCHEMBL1222666 | 0.77 | ALDH1A1 (0.30) | — | |
| SCHEMBL710882 | 0.77 | ALDH1A1 (0.30) | — | |
| SCHEMBL1222657 | 0.77 | ALDH1A1 (0.30) | — | |
| SCHEMBL8675219 | 0.77 | ALDH1A1 (0.30) | — | |
| SCHEMBL1223433 | 0.70 | — | — | |
| SCHEMBL1223149 | 0.70 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119630629-A | Process for producing 1,2,3, 4-tetrachloro-1, 2,3, 4-hexafluorobutane | 关东电化工业株式会社 | 2025-03-14 | — | — | CN | disclosed |
| EP-0497218-B1 | Process for preparing perhalogenated olefins | AUSIMONT SPA (IT) | 1997-06-04 | — | — | EP | disclosed |
| US-5177272-A | PROCESS FOR PREPARING PERHALOGENATED OLEFINS | AUSIMONT S.P.A. (IT) | 1993-01-05 | — | — | US | disclosed |
| EP-0497218-A2 | Process for preparing perhalogenated olefins | AUSIMONT S.p.A. (IT) | 1992-08-05 | — | — | EP | disclosed |