⚠ 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 | |
|---|---|---|---|---|
| Isoxazole SCHEMBL1318 | 0.96 | — | — | |
| Isoxazole SCHEMBL2679369 | 0.96 | PARP1 (1.00) | — | |
| Isoxazole SCHEMBL393230 | 0.96 | — | — | |
| Isoxazole SCHEMBL31018965 | 0.93 | — | — | |
| Isoxazole SCHEMBL2106061 | 0.93 | — | — | |
| Isoxazole SCHEMBL1312467 | 0.93 | — | — | |
| Isoxazole SCHEMBL29191776 | 0.93 | — | — | |
| Isoxazole SCHEMBL1118550 | 0.93 | — | — | |
| Isoxazole SCHEMBL21448373 | 0.93 | — | — | |
| Isoxazole SCHEMBL9491120 | 0.93 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105111198-B | Nitro isoxazole splices 2-Pyrrolidone class compound and preparation method and application | 贵州大学 | 2018-08-07 | — | — | CN | disclosed |
| CN-101031557-B | Substituted quinolones | AICURIS GMBH & CO KG | 2011-07-27 | — | — | CN | disclosed |
| US-7951827-B2 | Synthesis and antiprotozoal activity of dicationic 3,5-diphenylisoxazoles | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 2011-05-31 | — | — | US | disclosed |
| CN-100491316-C | Novel compounds, their preparation and use | NOVO NORDISK AS (US) | 2009-05-27 | — | — | CN | disclosed |
| CN-100457730-C | indole compounds having anti-diabetic activity | MERCK & CO INC (US) | 2009-02-04 | — | — | CN | disclosed |
| CN-101273013-A | Sulfonamide derivative having PGD2 receptor antagonistic activity | SHIONOGI & CO (JP) | 2008-09-24 | — | — | CN | disclosed |
| CN-101031557-A | Substituted quinolones | AICURIS GMBH & CO KG (DE) | 2007-09-05 | — | — | CN | disclosed |
| US-20060264487-A1 | Synthesis and antiprotozoal activity of dicationic 3,5-diphenylisoxazoles | TIDWELL RICHARD R | 2006-11-23 | — | — | US | disclosed |
| EP-1719767-A1 | Synthesis and antiprotozoal activity of dicationic 3,5-diphenylisoxazoles | The University of North Carolina at Chapel Hill (US) | 2006-11-08 | — | — | EP | disclosed |
| CN-1708468-A | Novel compounds, their preparation and use | NOVO NORDISK AS (DK) | 2005-12-14 | — | — | CN | disclosed |
| CN-1708479-A | Novel compounds useful in treating PPAR mediated diseases | NOVO NORDISK AS (DK) | 2005-12-14 | — | — | CN | disclosed |
| CN-1688540-A | Novel vinyl carboxylic acid derivatives and their therapeutical use | NOVO NORDISK AS (DK) | 2005-10-26 | — | — | CN | disclosed |
| CN-1678578-A | indole compounds having anti-diabetic activity | MERCK & CO INC (US) | 2005-10-05 | — | — | CN | disclosed |