⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4870864 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL811855 | 0.91 | — | — | |
| Fluoride Ion SCHEMBL5396236 | 0.91 | — | — | |
| Iodide SCHEMBL27948748 | 0.91 | — | — | |
| Bromide SCHEMBL5395223 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL11041276 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL27455710 | 0.88 | — | — | |
| Methane SCHEMBL27432275 | 0.88 | — | — | |
| Bromide SCHEMBL27277306 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL27640639 | 0.88 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7307177-B2 | Metallocene complexes, their synthesis and use in catalyst systems for olefin polymerization | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2007-12-11 | — | — | US | claimed |
| US-20060135353-A1 | Metallocene complexes, their synthesis and use in catalyst systems for olefin polymerization | EXXONMOBIL CHEMICAL PATENTS INC. | 2006-06-22 | — | — | US | claimed |
| WO-2006065468-A1 | METALLOCENE COMPLEXES, THEIR SYNTHESIS AND USE IN CATALYST SYSTEMS FOR OLEFIN POLYMERIZATION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2006-06-22 | — | — | WO | claimed |
| US-7307177-B2 | Metallocene complexes, their synthesis and use in catalyst systems for olefin polymerization | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2007-12-11 | — | — | US | disclosed |
| US-20060135353-A1 | Metallocene complexes, their synthesis and use in catalyst systems for olefin polymerization | EXXONMOBIL CHEMICAL PATENTS INC. | 2006-06-22 | — | — | US | disclosed |
| WO-2006065468-A1 | METALLOCENE COMPLEXES, THEIR SYNTHESIS AND USE IN CATALYST SYSTEMS FOR OLEFIN POLYMERIZATION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2006-06-22 | — | — | WO | disclosed |
| US-5756417-A | PHOSPHOLANE RING CONTAINING ORGANOMETALLIC POLYMERIZATION CATALYST TO CATALYZE OLEFINICALLY UNSATURATED HYDROCARBONS | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) | 1998-05-26 | — | — | US | disclosed |
| EP-0717754-B1 | CATALYST COMPOSITIONS | SHELL INT RESEARCH (NL) | 1997-12-03 | — | — | EP | disclosed |
| EP-0717754-A1 | CATALYST COMPOSITIONS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1996-06-26 | — | — | EP | disclosed |
| WO-1995004087-A1 | CATALYST COMPOSITIONS | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 1995-02-09 | — | — | WO | disclosed |