⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2988710 | 0.67 | — | — | |
| SCHEMBL7153912 | 0.65 | — | — | |
| Phosphine SCHEMBL7153914 | 0.65 | — | — | |
| Ethylene SCHEMBL9982853 | 0.63 | — | — | |
| SCHEMBL4652372 | 0.61 | — | — | |
| SCHEMBL7644177 | 0.61 | — | — | |
| SCHEMBL2631154 | 0.61 | — | — | |
| SCHEMBL11722086 | 0.61 | — | — | |
| SCHEMBL1921548 | 0.61 | — | — | |
| SCHEMBL1449113 | 0.61 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10844073-B2 | Palladium-mediated ketolization | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2020-11-24 | — | — | US | disclosed |
| US-10392400-B2 | Palladium-mediated ketolization | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2019-08-27 | — | — | US | disclosed |
| US-20180155361-A1 | PALLADIUM-MEDIATED KETOLIZATION | PRESIDENT AND FELLOWS OF HARVARD COLLEGE | 2018-06-07 | — | — | US | disclosed |
| CN-102171137-A | Method for producing carbonitride mixture particles or carbonitride mixture particles, and use thereof | SHOWA DENKO KK | 2011-08-31 | — | — | CN | disclosed |
| EP-1205494-B1 | Catalyst component and catalyst for addition polymerization, and process for producing addition polymers | SUMITOMO CHEMICAL CO (JP) | 2008-04-09 | — | — | EP | disclosed |
| US-6723807-B2 | CYCLOPENTADIENE METAL COMPLEX WITH NITROGEN AND AN ORGANOALUMINUM, AND AN ALUMINOXANE AND/OR BORON COMPOUND; HIGH ACTIVITY. | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2004-04-20 | — | — | US | disclosed |
| US-20030158355-A1 | Catalyst component and catalyst for addition polymerization, and process for producing addition polymer | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2003-08-21 | — | — | US | disclosed |
| US-20020091209-A1 | Catalyst component and catalyst for addition polymerization, and process for producing addition polymer | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2002-07-11 | — | — | US | disclosed |
| EP-1205494-A1 | Catalyst component and catalyst for addition polymerization, and process for producing addition polymers | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2002-05-15 | — | — | EP | disclosed |