⚠ 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 | |
|---|---|---|---|---|
| Propylene Oxide SCHEMBL9446523 | 0.93 | ALDH1A1 (0.35) | — | |
| SCHEMBL7872734 | 0.84 | ALDH1A1 (0.50) | — | |
| SCHEMBL7871898 | 0.84 | ALDH1A1 (0.50) | — | |
| Propylene Glycol SCHEMBL30592891 | 0.80 | TDP1 (0.50) | — | |
| SCHEMBL50349 | 0.79 | — | — | |
| SCHEMBL9720154 | 0.79 | ALDH1A1 (0.42) | — | |
| SCHEMBL7269472 | 0.79 | — | — | |
| SCHEMBL820347 | 0.79 | ALDH1A1 (0.37) | — | |
| Methane SCHEMBL11115500 | 0.77 | — | — | |
| SCHEMBL990032 | 0.76 | — | — |
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-9096713-B2 | Method for the phosphine-initialized production of hyperbranched polyols | BASF SE (DE) | 2015-08-04 | — | — | US | disclosed |
| US-20120101308-A1 | METHOD FOR THE PHOSPHINE-INITIALIZED PRODUCTION OF HYPERBRANCHED POLYOLS | BASF SE (DE) | 2012-04-26 | — | — | US | disclosed |
| CN-100371391-C | Resin composition and completed product | MITSUBISHI GAS CHEMICAL CO (JP) | 2008-02-27 | — | — | CN | disclosed |
| EP-1172400-B1 | THERMOPLASTIC RESIN FILM WITH SATISFACTORY PRINTABILITY | YUPO CORP (JP) | 2005-12-28 | — | — | EP | disclosed |
| CN-1550522-A | Resin composition and completed product | 三菱瓦斯化学株式会社 | 2004-12-01 | — | — | CN | disclosed |
| US-6586106-B2 | Ink transfer, adhesion and aging stability, and being satisfactory in back ghost when offset printing using oxidation polymerization type ink is performed on both faces | YUPO CORPORATION (JP) | 2003-07-01 | — | — | US | disclosed |
| US-20020054991-A1 | Thermoplastic resin film satisfactory in printability | YUPO CORPORATION (JP) | 2002-05-09 | — | — | US | disclosed |
| EP-1172400-A1 | THERMOPLASTIC RESIN FILM WITH SATISFACTORY PRINTABILITY | Yupo Corporation (JP) | 2002-01-16 | — | — | EP | disclosed |