⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22768244 | 0.83 | ALDH1A1 (0.40) | — | |
| SCHEMBL22762154 | 0.81 | LGALS1 (0.42) | — | |
| SCHEMBL21037780 | 0.81 | LGALS1 (0.42) | — | |
| SCHEMBL51196 | 0.81 | — | — | |
| SCHEMBL6440323 | 0.80 | ALDH1A1 (0.32) | — | |
| SCHEMBL6434412 | 0.80 | — | — | |
| SCHEMBL28042234 | 0.80 | ALDH1A1 (0.32) | — | |
| SCHEMBL1274422 | 0.80 | CTSK (0.30) | — | |
| SCHEMBL52186 | 0.79 | — | — | |
| SCHEMBL6434306 | 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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1172400-B1 | THERMOPLASTIC RESIN FILM WITH SATISFACTORY PRINTABILITY | YUPO CORP (JP) | 2005-12-28 | — | — | EP | disclosed |
| CN-1155550-C | Catalyst stabilising additive in the hydrolysis of alkylene oxides | ���ʿ����о�����˾ | 2004-06-30 | — | — | CN | disclosed |
| CN-1149186-C | Quaternary phosphonium salt catalysts in the catalytic hydrolysis of alkylene oxides | ���ʿ����о�����˾ | 2004-05-12 | — | — | CN | disclosed |
| CN-1146532-C | Carboxylates in catalytic hydrolysis of alkylene oxides | 国际壳牌研究有限公司 | 2004-04-21 | — | — | CN | disclosed |
| CN-1116259-C | Catalytic hydrolysis of alkylene oxides | SHELL INT RESEARCH (NL) | 2003-07-30 | — | — | 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 |
| CN-1333739-A | Catalyst stabilising additive in the hydrolysis of alkylene oxides | SHELL INTENATIONALE RES MIJ B (NL) | 2002-01-30 | — | — | CN | disclosed |
| CN-1333738-A | Carboxylates in catalytic hydrolysis of alkylene oxides | SHELL INTELRNAITONALE RES MIJ (NL) | 2002-01-30 | — | — | CN | disclosed |
| EP-1172400-A1 | THERMOPLASTIC RESIN FILM WITH SATISFACTORY PRINTABILITY | Yupo Corporation (JP) | 2002-01-16 | — | — | EP | disclosed |
| CN-1074402-C | Process for the preparation of alkylene glycols | SHELL INT RESEARCH (NL) | 2001-11-07 | — | — | CN | disclosed |
| CN-1071295-C | Process for the preparation of alkylene glycols | SHELL INT RESEARCH (NL) | 2001-09-19 | — | — | CN | disclosed |
| CN-1278236-A | Catalytic hydrolysis of alkylene oxides | SHELL INT RESEARCH (NL) | 2000-12-27 | — | — | CN | disclosed |
| CN-1202879-A | Process for the preparation of alkylene glycols | SHELL INT RESEARCH (NL) | 1998-12-23 | — | — | CN | disclosed |
| CN-1139916-A | Process for the preparation of alkylene glycols | SHELL INT RESEARCH (NL) | 1997-01-08 | — | — | CN | disclosed |