⚠ 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL27932911 | 0.96 | — | — | |
| Hydrochloric Acid SCHEMBL1670651 | 0.96 | — | — | |
| Iodide SCHEMBL27932971 | 0.96 | — | — | |
| Hydrochloric Acid SCHEMBL27855360 | 0.89 | ACHE (0.33) | — | |
| Fluoride Ion SCHEMBL5077421 | 0.88 | — | — | |
| Bromide SCHEMBL27948659 | 0.83 | — | — | |
| Iodide SCHEMBL27948701 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL7938792 | 0.83 | — | — | |
| Fluoride Ion SCHEMBL27948951 | 0.79 | — | — | |
| SCHEMBL924416 | 0.77 | NPC1 (0.33) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103509060-A | Metallocene compound, catalyst composite containing metallocene compound and olefin polymerization method using metallocene compound | DAELIM IND CO LTD | 2014-01-15 | — | — | CN | disclosed |
| EP-1673400-A4 | POLYMERIZATION PROCESS AND CONTROL OF POLYMER COMPOSITION PROPERTIES | UNIVATION TECH LLC (US) | 2007-07-11 | — | — | EP | disclosed |
| EP-1673401-A4 | POLYMERIZATION PROCESS AND CONTROL OF POLYMER COMPOSITION PROPERTIES | UNIVATION TECH LLC (US) | 2007-07-11 | — | — | EP | disclosed |
| EP-1673401-A1 | POLYMERIZATION PROCESS AND CONTROL OF POLYMER COMPOSITION PROPERTIES | Univation Technologies, LLC (US) | 2006-06-28 | — | — | EP | disclosed |
| EP-1673400-A1 | POLYMERIZATION PROCESS AND CONTROL OF POLYMER COMPOSITION PROPERTIES | Univation Technologies, LLC (US) | 2006-06-28 | — | — | EP | disclosed |
| WO-2005044866-A1 | POLYMERIZATION PROCESS AND CONTROL OF POLYMER COMPOSITION PROPERTIES | UNIVATION TECHNOLOGIES, LLC (US) | 2005-05-19 | — | — | WO | disclosed |
| WO-2005044863-A1 | POLYMERIZATION PROCESS AND CONTROL OF POLYMER COMPOSITION PROPERTIES | UNIVATION TECHNOLOGIES, LLC (US) | 2005-05-19 | — | — | WO | disclosed |