⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12274071 | 0.93 | — | — | |
| SCHEMBL28522185 | 0.80 | ALDH1A1 (0.31) | — | |
| SCHEMBL28573942 | 0.78 | ALDH1A1 (0.42) | — | |
| Acrylic Acid Methyl Ester SCHEMBL28516280 | 0.78 | SLC6A3 (0.31) | — | |
| SCHEMBL4454838 | 0.77 | — | — | |
| SCHEMBL10931805 | 0.77 | — | — | |
| SCHEMBL13694459 | 0.73 | — | — | |
| SCHEMBL6658223 | 0.72 | — | — | |
| SCHEMBL19575626 | 0.70 | — | — | |
| SCHEMBL26012 | 0.69 | ALDH1A1 (0.57) | — |
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 55 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3940246-A | Sublimation transfer and isocyanate fixation of amino- or hydroxy-containing dyestuffs and transfer sheets therefor | CIBA-GEIGY AG (CH) | 1976-02-24 | — | — | US | claimed |
| CN-115286592-A | GLUT1 inhibitor, virtual screening method and application | 武汉工程大学 | 2022-11-04 | — | — | CN | disclosed |
| CN-109810086-B | Isocyanate with unsaturated group and preparation method and application thereof | 万华化学集团股份有限公司 | 2021-02-02 | — | — | CN | disclosed |
| US-7943616-B2 | Protein kinase inhibitors; astham; psoriasis; antiinflammatory agents; inflammatory bowel disorders | AVENTIS PHARMACEUTICALS INC. (US) | 2011-05-17 | — | — | US | disclosed |
| EP-2233486-A1 | Azaindoles | Aventis Pharma Limited (GB) | 2010-09-29 | — | — | EP | disclosed |
| WO-2007088152-A1 | PROCESS FOR PREPARING ISOCYANATES | BASF SE (DE) | 2007-08-09 | — | — | WO | disclosed |
| EP-1372648-B1 | TIE2 RECEPTOR KINASE INHIBITORS FOR TREATING ANGIOGENIC DISEASES | SMITHKLINE BEECHAM CORP (US) | 2006-03-15 | — | — | EP | disclosed |
| US-7005434-B2 | Compounds and uses thereof | SB CORPORATION (US) | 2006-02-28 | — | — | US | disclosed |
| US-20050267304-A1 | Protein kinase inhibitors; astham; psoriasis; antiinflammatory agents; inflammatory bowel disorders | AVENTIS PHARMACEUTICALS INC. (US) | 2005-12-01 | — | — | US | disclosed |
| EP-1263427-A4 | IL-8 RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORP (US) | 2005-08-24 | — | — | EP | disclosed |
| EP-0532178-A1 | Methanoanthracenes as dopamine antagonists | ZENECA LIMITED (GB) | 1993-03-17 | — | — | EP | disclosed |
| WO-1992015664-A1 | AQUEOUS TEXTILE AUXILIARY COMPOSITION | CIBA-GEIGY AG (CH) | 1992-09-17 | — | — | WO | disclosed |
| US-4442116-A | MITICIDES | NIPPON SODA COMPANY, LIMITED (JP) | 1984-04-10 | — | — | US | disclosed |
| US-4431814-A | HERBICIDES, MITICIDES, ANTICONVULSANTS | NIPPON SODA COMPANY LIMITED (JP) | 1984-02-14 | — | — | US | disclosed |
| US-4125724-A | OF AN ISOCYANATE TO A FORMAMIDO, PLATINUM OR PALLADIUM CATALYST | BRISTOL-MYERS COMPANY (US) | 1978-11-14 | — | — | US | disclosed |
| US-4078886-A | Sublimation transfer and diisocyanate fixation of amino- or hydroxy-containing anthraquinone dyestuffs and transfer sheets thereof | CIBA-GEIGY AG (CH) | 1978-03-14 | — | — | US | disclosed |
| US-4000298-A | Novel fungicidal composition and method using benzimidazole derivatives | ROUSSEL-UCLAF (FR) | 1976-12-28 | — | — | US | disclosed |
| US-3958933-A | Process for the manufacture of fast dyeings on synthetic hydrophobic textile material | CIBA-GEIGY CORPORATION (US) | 1976-06-01 | — | — | US | disclosed |
| US-3940246-A | Sublimation transfer and isocyanate fixation of amino- or hydroxy-containing dyestuffs and transfer sheets therefor | CIBA-GEIGY AG (CH) | 1976-02-24 | — | — | US | disclosed |
| US-3932447-A | FUNGICIDES | ROUSSEL-UCLAF (FR) | 1976-01-13 | — | — | US | disclosed |