⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL987881 | 0.81 | ALDH1A1 (0.33) | — | |
| SCHEMBL4889347 | 0.78 | — | — | |
| SCHEMBL5407022 | 0.77 | EGFR (0.33) | — | |
| SCHEMBL1705336 | 0.77 | — | — | |
| SCHEMBL4896163 | 0.74 | — | — | |
| SCHEMBL636824 | 0.72 | POLB (0.31) | — | |
| SCHEMBL22753318 | 0.72 | POLB (0.31) | — | |
| SCHEMBL13482389 | 0.71 | — | — | |
| SCHEMBL2183460 | 0.71 | — | — | |
| SCHEMBL14394010 | 0.69 | — | — |
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-7543843-B2 | Airbag coatings made with hybrid resin compositions | MILLIKEN & COMPANY (US) | 2009-06-09 | — | — | US | disclosed |
| US-20080110663-A1 | Communications Cable-Flame Retardant Separator | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY LLC | 2008-05-15 | — | — | US | disclosed |
| US-20080036183-A1 | Airbag coatings made with hybrid resin compositions | MILLIKEN & COMPANY | 2008-02-14 | — | — | US | disclosed |
| EP-1597308-A1 | FLAME RETARDANT COMPOSITION | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) | 2005-11-23 | — | — | EP | disclosed |
| WO-2004074361-A1 | FLAME RETARDANT COMPOSITION | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) | 2004-09-02 | — | — | WO | disclosed |
| EP-0933352-B1 | Improved process for the preparation of substituted hydroxyhydrocinnamate esters by removal of tin catalysts | CIBA SC HOLDING AG (CH) | 2003-03-12 | — | — | EP | disclosed |
| US-6291703-B1 | CONTINUOUSLY INTRODUCING THE ALKANOL OR POLYOL AND ALKYL MONO-ESTER INTO HEATED DISTILATION COLUMN REACTOR CONTAINING TRANSESTERIFICATION CATALYST TO FORM HYDROXYCINNAMATE ESTER; SEPARATION; REMOVING ESTER AND ALCOHOL | CIBA SPECIALTY CHEMICALS CORPORATION | 2001-09-18 | — | — | US | disclosed |
| US-6184411-B1 | REMOVAL OF RESIDUAL TIN CATALYST FROM SUBSTITUTED HIGHER ALIPHATIC ESTERS OF HYDROXYHYDROCINNAMIC ACIDS MADE BY THE TIN SOURCE-CATALYZED TRANSESTERIFICATION REACTION BETWEEN THE CORRESPONDING LOWER ALKYL ESTER AND HIGHER ALKANOL | CIBA SPECIALTY CHEMICALS CORPORATION | 2001-02-06 | — | — | US | disclosed |
| EP-0933352-A1 | Improved process for the preparation of substituted hydroxyhydrocinnamate esters by removal of tin catalysts | Ciba SC Holding AG (CH) | 1999-08-04 | — | — | EP | disclosed |