⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3219 | 1.00 | — | — | |
| SCHEMBL12203926 | 1.00 | — | — | |
| SCHEMBL272959 | 1.00 | — | — | |
| SCHEMBL12334971 | 1.00 | ALDH1A1 (0.36) | — | |
| SCHEMBL2183062 | 1.00 | — | — | |
| SCHEMBL7933931 | 1.00 | — | — | |
| SCHEMBL23934877 | 0.96 | ALDH1A1 (0.33) | — | |
| SCHEMBL51905 | 0.96 | ALDH1A1 (0.33) | — | |
| SCHEMBL7944366 | 0.96 | ALDH1A1 (0.33) | — | |
| Water SCHEMBL8733652 | 0.96 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2763756-B1 | BROMOFLUOROCARBON COMPOSITIONS | AMERICAN PACIFIC CORP (US) | 2019-06-12 | — | — | EP | disclosed |
| US-8858820-B2 | Bromofluorocarbon compositions | AMERICAN PACIFIC CORPORATION (US) | 2014-10-14 | — | — | US | disclosed |
| EP-2763756-A1 | BROMOFLUOROCARBON COMPOSITIONS | American Pacific Corporation (US) | 2014-08-13 | — | — | EP | disclosed |
| US-20130146316-A1 | BROMOFLUOROCARBON COMPOSITIONS | AMERICAN PACIFIC CORPORATION (US) | 2013-06-13 | — | — | US | disclosed |
| WO-2013052850-A1 | BROMOFLUOROCARBON COMPOSITIONS | AMERICAN PACIFIC CORPORATION (US) | 2013-04-11 | — | — | WO | disclosed |