⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31509293 | 0.81 | KDM4E (0.34) | — | |
| SCHEMBL23057518 | 0.81 | GNAI3 (0.37) | — | |
| SCHEMBL8950596 | 0.79 | — | — | |
| SCHEMBL351946 | 0.78 | EPHX1 (0.39) | — | |
| SCHEMBL23953159 | 0.76 | GNAI3 (0.31) | — | |
| SCHEMBL10306106 | 0.75 | CYP4F2 (0.38) | — | |
| SCHEMBL12960406 | 0.75 | — | — | |
| SCHEMBL1791564 | 0.73 | CYP4F2 (0.37) | — | |
| Cyanide SCHEMBL27855086 | 0.72 | EPHX1 (0.34) | — | |
| SCHEMBL26091441 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1833870-B1 | DURABLE COATING COMPOSITIONS CONTAINING NOVEL ASPARTIC AMINE COMPOUNDS | DU PONT (US) | 2011-05-11 | — | — | EP | disclosed |
| US-7682665-B2 | Durable coating compositions containing novel aspartic amine compounds | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2010-03-23 | — | — | US | disclosed |
| US-7674499-B2 | Durable coating compositions containing novel aspartic amine compounds | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2010-03-09 | — | — | US | disclosed |
| EP-1833870-A1 | DURABLE COATING COMPOSITIONS CONTAINING NOVEL ASPARTIC AMINE COMPOUNDS | E.I.Du pont de nemours and company (US) | 2007-09-19 | — | — | EP | disclosed |
| US-7214828-B2 | Durable coating compositions containing novel aspartic amine compounds | E. I. DUPONT DE NEMOURS AND COMPANY (US) | 2007-05-08 | — | — | US | disclosed |
| US-20060155054-A1 | Durable coating compositions containing novel aspartic amine compounds | AXALTA COATING SYSTEMS IP CO. LLC (FORMERLY KNOWN AS U.S. COATINGS IP CO. LLC) | 2006-07-13 | — | — | US | disclosed |
| US-20060155053-A1 | Durable coating compositions containing novel aspartic amine compounds | AXALTA COATING SYSTEMS IP CO. LLC (FORMERLY KNOWN AS U.S. COATINGS IP CO. LLC) | 2006-07-13 | — | — | US | disclosed |
| US-20060155148-A1 | Durable coating compositions containing novel aspartic amine compounds | AXALTA COATING SYSTEMS IP CO. LLC (FORMERLY KNOWN AS U.S. COATINGS IP CO. LLC) | 2006-07-13 | — | — | US | disclosed |
| WO-2006066026-A1 | DURABLE COATING COMPOSITIONS CONTAINING NOVEL ASPARTIC AMINE COMPOUNDS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2006-06-22 | — | — | WO | disclosed |