⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2926726 | 0.72 | — | — | |
| SCHEMBL4652591 | 0.71 | ESR1 (0.30) | — | |
| SCHEMBL7622836 | 0.71 | — | — | |
| SCHEMBL7945971 | 0.71 | — | — | |
| SCHEMBL8523575 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL5909730 | 0.69 | — | — | |
| SCHEMBL9143873 | 0.69 | — | — | |
| SCHEMBL9143969 | 0.69 | — | — | |
| SCHEMBL4652414 | 0.66 | — | — | |
| SCHEMBL6673852 | 0.66 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0990003-B1 | NEW CATALYST SYSTEMS FOR (CO-)POLYMERIZATION REACTIONS, METALLOCENE AMIDE HALOGENIDES AND USE THEREOF | PEROXID CHEMIE GMBH & CO KG (DE) | 2002-09-04 | — | — | EP | disclosed |
| US-6316562-B1 | USED FOR POLYMERIZATION OF OLEFINS | PEROXID-CHEMIE GMBH & CO. KG (DE) | 2001-11-13 | — | — | US | disclosed |
| EP-1028123-A2 | Process for the preparation of metallocene compounds | Peroxid-Chemie GmbH & Co. KG. (DE) | 2000-08-16 | — | — | EP | disclosed |
| EP-0990003-A1 | NEW CATALYST SYSTEMS FOR (CO-)POLYMERIZATION REACTIONS, METALLOCENE AMIDE HALOGENIDES, THE PRODUCTION AND USE THEREOF | Peroxid-Chemie GmbH & Co. KG. (DE) | 2000-04-05 | — | — | EP | disclosed |
| WO-1998056831-A1 | NEW CATALYST SYSTEMS FOR (CO-)POLYMERIZATION REACTIONS, METALLOCENE AMIDE HALOGENIDES, THE PRODUCTION AND USE THEREOF | PEROXID-CHEMIE GMBH & CO. KG. (DE) | 1998-12-17 | — | — | WO | disclosed |