⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14977418 | 0.83 | CYP3A4 (0.30) | — | |
| SCHEMBL6534877 | 0.80 | MMP9 (0.37) | — | |
| SCHEMBL8718879 | 0.80 | MMP9 (0.37) | — | |
| SCHEMBL14977496 | 0.78 | — | — | |
| SCHEMBL16892589 | 0.77 | ACE2 (0.40) | — | |
| Cyclohexane SCHEMBL31251934 | 0.76 | MMP9 (0.35) | — | |
| Cyclohexane SCHEMBL29366779 | 0.76 | MMP9 (0.35) | — | |
| Cyclohexane SCHEMBL30825744 | 0.76 | MMP9 (0.35) | — | |
| SCHEMBL20740831 | 0.66 | GPR84 (0.40) | — | |
| SCHEMBL6451502 | 0.63 | ACE2 (0.42) | — |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2785752-B1 | INTERNAL ELECTRON DONOR FOR OLEFIN POLYMERIZATION CATALYSTS, METHOD OF MAKING AND USING THE SAME | BRASKEM AMERICA INC (US) | 2023-05-31 | — | — | EP | claimed |
| US-9217047-B2 | Internal donor structure for olefin polymerization catalysts and methods of making and using same | BASF CORPORATION (US) | 2015-12-22 | — | — | US | claimed |
| US-20140235805-A1 | INTERNAL DONOR STRUCTURE FOR OLEFIN POLYMERIZATION CATALYSTS AND METHODS OF MAKING AND USING SAME | BASF CORPORATION (US) | 2014-08-21 | — | — | US | claimed |
| US-20130231447-A1 | NEW INTERNAL DONORS FOR ETHYLENE POLYMERIZATION CATALYSTS AND METHODS OF MAKING AND USING SAME II | BASF CORPORATION (US) | 2013-09-05 | — | — | US | claimed |
| US-20130137568-A1 | Internal Donor Structure for Olefin Polymerization Catalysts and Methods of Making and Using Same | BASF CORPORATION | 2013-05-30 | — | — | US | claimed |
| EP-2785752-B1 | INTERNAL ELECTRON DONOR FOR OLEFIN POLYMERIZATION CATALYSTS, METHOD OF MAKING AND USING THE SAME | BRASKEM AMERICA INC (US) | 2023-05-31 | — | — | EP | disclosed |
| US-10144790-B2 | Internal donor structure for olefin polymerization catalysts and methods of making and using same | W.R. GRACE & CO.-CONN. (US) | 2018-12-04 | — | — | US | disclosed |
| US-20170121433-A1 | INTERNAL DONOR STRUCTURE FOR OLEFIN POLYMERIZATION CATALYSTS AND METHODS OF MAKING AND USING SAME | W. R. GRACE & CO.-CONN. | 2017-05-04 | — | — | US | disclosed |
| US-9567410-B2 | Internal donor structure for olefin polymerization catalysts and methods of making and using same | W.R. GRACE & CO.-CONN. (US) | 2017-02-14 | — | — | US | disclosed |
| US-20160145358-A1 | INTERNAL DONOR STRUCTURE FOR OLEFIN POLYMERIZATION CATALYSTS AND METHODS OF MAKING AND USING SAME | W. R. GRACE & CO.-CONN. | 2016-05-26 | — | — | US | disclosed |
| US-9217047-B2 | Internal donor structure for olefin polymerization catalysts and methods of making and using same | BASF CORPORATION (US) | 2015-12-22 | — | — | US | disclosed |
| US-20140235805-A1 | INTERNAL DONOR STRUCTURE FOR OLEFIN POLYMERIZATION CATALYSTS AND METHODS OF MAKING AND USING SAME | BASF CORPORATION (US) | 2014-08-21 | — | — | US | disclosed |
| US-8765626-B2 | Internal donor structure for olefin polymerization catalysts and methods of making and using same | BASF CORPORATION (US) | 2014-07-01 | — | — | US | disclosed |
| US-20130231447-A1 | NEW INTERNAL DONORS FOR ETHYLENE POLYMERIZATION CATALYSTS AND METHODS OF MAKING AND USING SAME II | BASF CORPORATION (US) | 2013-09-05 | — | — | US | disclosed |
| US-20130137568-A1 | Internal Donor Structure for Olefin Polymerization Catalysts and Methods of Making and Using Same | BASF CORPORATION | 2013-05-30 | — | — | US | disclosed |