⚠ 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 | |
|---|---|---|---|---|
| Cyclohexane SCHEMBL15771043 | 1.00 | — | — | |
| Ethane SCHEMBL5833696 | 0.86 | ALDH1A1 (0.31) | — | |
| Methane SCHEMBL4884575 | 0.86 | ALDH1A1 (0.31) | — | |
| Ethylene SCHEMBL5834104 | 0.83 | — | — | |
| Adamantane SCHEMBL8519642 | 0.79 | — | — | |
| SCHEMBL28418332 | 0.68 | — | — | |
| SCHEMBL729846 | 0.68 | — | — | |
| SCHEMBL5420209 | 0.67 | ALDH1A1 (0.33) | — | |
| SCHEMBL19927050 | 0.67 | — | — | |
| Tert-Butylamine SCHEMBL28650973 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101945898-B | Catalyst component for ethylene polymerization and process for producing ethylene polymer (2) | SUMITOMO CO LTD | 2012-10-10 | — | — | CN | disclosed |
| CN-101945898-A | Catalyst component for ethylene polymerization and process for producing ethylene polymer (2) | SUMITOMO CHEMICAL CO | 2011-01-12 | — | — | CN | disclosed |
| US-7081427-B2 | Solid catalyst component for olefin polymerization | IDEMITSU KOSAN CO., LTD. (JP) | 2006-07-25 | — | — | US | disclosed |
| US-20040102310-A1 | Solid catalyst component for olefin polymerization | IDEMITSU KOSAN CO., LTD. (JP) | 2004-05-27 | — | — | US | disclosed |
| EP-1396503-A1 | SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION | IDEMITSU PETROCHEMICAL CO., LTD. (JP) | 2004-03-10 | — | — | EP | disclosed |
| CN-1116315-C | Polypropylene resin composition and injection-molded article | GRAND POLYMER CO LTD (JP) | 2003-07-30 | — | — | CN | disclosed |
| CN-1236375-A | Polypropylene resin composition and injection-molded article | GRAND POLYMER CO LTD (JP) | 1999-11-24 | — | — | CN | disclosed |
| EP-0930320-A1 | ETHYLENE/ALPHA-OLEFIN COPOLYMERS, COMPOSITIONS, AND PROCESSES FOR THE PREPARATION OF THE COPOLYMERS AND THE COMPOSITIONS | Mitsui Chemicals, Inc. (JP) | 1999-07-21 | — | — | EP | disclosed |
| CN-1036344-C | Solid titanium catalyst component for olefin polymerization, process for preparing the same, catalyst for olefin polymerization and process for olefin polymerization | MITSUI PETROCHEMICAL IND (JP) | 1997-11-05 | — | — | CN | disclosed |
| CN-1087094-A | Solid titanium catalyst component of olefinic polyreaction and preparation method thereof, the catalyzer of olefinic polyreaction and method thereof | MITSUI PETROCHEMICAL IND (JP) | 1994-05-25 | — | — | CN | disclosed |