⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6237587 | 1.00 | — | — | |
| SCHEMBL333007 | 0.92 | — | — | |
| SCHEMBL333006 | 0.92 | — | — | |
| SCHEMBL333053 | 0.82 | — | — | |
| SCHEMBL2327904 | 0.82 | — | — | |
| SCHEMBL333054 | 0.82 | — | — | |
| SCHEMBL332901 | 0.81 | — | — | |
| SCHEMBL332902 | 0.81 | — | — | |
| SCHEMBL332706 | 0.77 | — | — | |
| SCHEMBL21160289 | 0.71 | — | — |
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-20050247670-A1 | Method of dry etching, dry etching gas and process for producing perfluoro-2-pentyne | ZEON CORPORATION (JP) | 2005-11-10 | — | — | US | disclosed |
| EP-1542268-A1 | METHOD OF DRY ETCHING, DRY ETCHING GAS AND PROCESS FOR PRODUCING PERFLUORO-2-PENTYNE | Zeon Corporation (JP) | 2005-06-15 | — | — | EP | disclosed |