⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8461804 | 0.82 | TP53 (0.32) | — | |
| SCHEMBL268874 | 0.76 | — | — | |
| SCHEMBL4223240 | 0.75 | — | — | |
| SCHEMBL8458675 | 0.75 | — | — | |
| SCHEMBL8461374 | 0.75 | ALDH1A1 (0.35) | — | |
| SCHEMBL8459467 | 0.74 | — | — | |
| SCHEMBL2574572 | 0.74 | TSHR (0.40) | — | |
| SCHEMBL8462061 | 0.74 | — | — | |
| SCHEMBL24496434 | 0.72 | LMNA (0.30) | — | |
| SCHEMBL8392786 | 0.71 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11695156-B2 | Additives for lithium batteries and methods | UCHICAGO ARGONNE, LLC (US) | 2023-07-04 | — | — | US | disclosed |
| CN-1138743-C | 1, 3-diketone compound | ض� | 2004-02-18 | — | — | CN | disclosed |
| CN-1054139-C | Catalyst component for the polymerization of olefins and catalyst obtained | MONTELL NORTH AMERICAN INC (US) | 2000-07-05 | — | — | CN | disclosed |
| CN-1257061-A | 1, 3-diketone compound | MONTELL NORTH AMERICAN INC (US) | 2000-06-21 | — | — | CN | disclosed |
| EP-0646605-B1 | Components and catalysts for the polymerization of olefins | MONTELL NORTH AMERICA INC (US) | 1999-06-02 | — | — | EP | disclosed |
| US-5468704-A | Comprising titanium halide or halogen alcoholate supported on magnesium halide and a diketone electron donor; preparing polypropylene of high isotacticity | MONTELL NORTH AMERICA INC. (US) | 1995-11-21 | — | — | US | disclosed |
| CN-1105671-A | Components and catalysts for olefin polymerization | HIMONT INC (US) | 1995-07-26 | — | — | CN | disclosed |
| EP-0646605-A1 | Components and catalysts for the polymerization of olefins | MONTELL NORTH AMERICA INC. (US) | 1995-04-05 | — | — | EP | disclosed |