⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL254501 | 0.95 | — | — | |
| SCHEMBL27554614 | 0.95 | — | — | |
| SCHEMBL6983119 | 0.95 | — | — | |
| SCHEMBL23356471 | 0.95 | — | — | |
| SCHEMBL108729 | 0.91 | ALDH1A1 (0.47) | — | |
| Hydrochloric Acid SCHEMBL9716582 | 0.91 | — | — | |
| Trichloromonofluoromethane SCHEMBL27433994 | 0.87 | ALDH1A1 (0.44) | — | |
| Hydrochloric Acid SCHEMBL9716581 | 0.87 | — | — | |
| SCHEMBL9351096 | 0.87 | ALDH1A1 (0.44) | — | |
| Oxirane SCHEMBL9311808 | 0.86 | ALDH1A1 (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0494994-B1 | FLUOROCARBON PURIFICATION PROCESS | DU PONT (US) | 1997-08-27 | — | — | EP | disclosed |
| US-5461177-A | Reacting excess of hydrogen fluoride with halocarbon to form halocarbon product, excess hydrogen fluoride combined as an azeotrope with additional halogcarbon or halo-olefin, over fluorination catalyst, recovery and reuse | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1995-10-24 | — | — | US | disclosed |
| EP-0494994-A1 | FLUOROCARBON PURIFICATION PROCESS. | DU PONT (US) | 1992-07-22 | — | — | EP | disclosed |
| WO-1991004955-A1 | FLUOROCARBON PURIFICATION PROCESS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1991-04-18 | — | — | WO | disclosed |