⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL395447 | 0.98 | — | — | |
| SCHEMBL4576590 | 0.98 | — | — | |
| SCHEMBL4576262 | 0.79 | — | — | |
| SCHEMBL2381967 | 0.73 | CTSD (0.33) | — | |
| SCHEMBL4577188 | 0.71 | CTSD (0.32) | — | |
| Bromide SCHEMBL863747 | 0.71 | CTSD (0.32) | — | |
| Fluoride SCHEMBL864718 | 0.71 | CTSD (0.32) | — | |
| Iodide SCHEMBL863901 | 0.71 | CTSD (0.32) | — | |
| Hydrochloric Acid SCHEMBL396675 | 0.71 | CTSD (0.32) | — | |
| SCHEMBL4480097 | 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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1448568-A4 | DICOPS CONTAINING ACETYLENIC SUBSTITUENTS | EXXONMOBIL CHEM PATENTS INC (US) | 2008-02-13 | — | — | EP | disclosed |
| EP-1605000-A1 | ULTRAHIGH-MOLECULAR ETHYLENE POLYMER | Asahi Kasei Chemicals Corporation (JP) | 2005-12-14 | — | — | EP | disclosed |
| EP-1448568-A2 | DICOPS CONTAINING ACETYLENIC SUBSTITUENTS | ExxonMobil Chemical Patents Inc. (US) | 2004-08-25 | — | — | EP | disclosed |
| WO-2003040070-A2 | DICOPS CONTAINING ACETYLENIC SUBSTITUENTS | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2003-05-15 | — | — | WO | disclosed |
| US-6388032-B1 | SEPARATION BY FILTRATION | TEIJIN LIMITED (JP) | 2002-05-14 | — | — | US | disclosed |
| EP-1028128-A1 | CYCLOOLEFIN POLYMER REDUCED IN CATALYST RESIDUE CONTENT, USE THEREOF, AND PROCESS FOR PRODUCING THE SAME | TEIJIN LIMITED (JP) | 2000-08-16 | — | — | EP | disclosed |