⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9719473 | 0.77 | — | — | |
| SCHEMBL9719506 | 0.72 | — | — | |
| SCHEMBL202990 | 0.70 | — | — | |
| SCHEMBL728264 | 0.70 | — | — | |
| SCHEMBL27917455 | 0.69 | — | — | |
| SCHEMBL11055691 | 0.69 | — | — | |
| SCHEMBL432042 | 0.67 | — | — | |
| SCHEMBL10884786 | 0.67 | — | — | |
| SCHEMBL9805228 | 0.67 | — | — | |
| SCHEMBL28924690 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0319153-B1 | PREPARATION OF 3,3,3-TRIFLUOROPROPENE-1 | DOW CORNING CORPORATION (US) | 1992-07-01 | — | — | EP | disclosed |
| EP-0319153-A1 | Preparation of 3,3,3-trifluoropropene-1 | DOW CORNING CORPORATION (US) | 1989-06-07 | — | — | EP | disclosed |
| US-4798818-A | ALUMINUM FLUORIDE, TRANSITION METAL COMPOUND, HYDROGEN FLUORIDE | DOW CORNING CORPORATION (US) | 1989-01-17 | — | — | US | disclosed |