⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21986189 | 1.00 | — | — | |
| SCHEMBL3941312 | 0.93 | — | — | |
| SCHEMBL12765086 | 0.93 | — | — | |
| SCHEMBL2760263 | 0.93 | — | — | |
| SCHEMBL28218472 | 0.85 | DPP4 (0.42) | — | |
| SCHEMBL31105494 | 0.82 | — | — | |
| SCHEMBL15316993 | 0.78 | — | — | |
| SCHEMBL4758300 | 0.78 | — | — | |
| SCHEMBL7024273 | 0.76 | — | — | |
| SCHEMBL2090378 | 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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4219499-A1 | A CLASS OF FUSED RING COMPOUNDS, AND PREPARATION AND USE THEREOF | CSPC Zhongqi Pharmaceutical Technology (Shijiazhuang) Co., Ltd. (CN) | 2023-08-02 | — | — | EP | disclosed |
| EP-3507275-B1 | CXCR3 RECEPTOR AGONISTS | RECEPTOS LLC (US) | 2023-04-26 | — | — | EP | disclosed |
| WO-2018045246-A1 | CXCR3 RECEPTOR AGONISTS | CELGENE INTERNATIONAL II SARL (CH) | 2018-03-08 | — | — | WO | disclosed |
| US-20170097567-A1 | METHOD FOR PRODUCING POLYMER | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2017-04-06 | — | — | US | disclosed |
| US-20160229940-A1 | POLYMER, RESIST COMPOSITION, AND PATTERN FORMING PROCESS | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2016-08-11 | — | — | US | disclosed |
| EP-1572631-B1 | ORGANIC ACTIVATOR | PROCTER & GAMBLE (US) | 2009-04-15 | — | — | EP | disclosed |
| US-7030075-B2 | Organic activator | PROCTER & GAMBLE COMPANY (US) | 2006-04-18 | — | — | US | disclosed |
| US-20060074001-A1 | Organic activator | MIRACLE GREOGORY S | 2006-04-06 | — | — | US | disclosed |
| CN-1741989-A | Organic activator | PROCTER & GAMBLE (US) | 2006-03-01 | — | — | CN | disclosed |
| EP-1572631-A2 | ORGANIC ACTIVATOR | The Procter & Gamble Company (US) | 2005-09-14 | — | — | EP | disclosed |
| WO-2004060856-A2 | ORGANIC ACTIVATOR | THE PROCTER & GAMBLE COMPANY (US) | 2004-07-22 | — | — | WO | disclosed |
| US-20040142844-A1 | bleach activators; N-hydroxyalkyl quaternary ammonium acetonitriles, e.g., 1-cyano-N,N-dimethyl-N-(3-hydroxypropyl)methanaminium chloride or quaternary ammonium acetonitrile inner salts, e.g., 5-carboxy-N,N-dimethyl-N-(cyanomethyl)-1-pentanaminium | THE PROCTER & GAMBLE COMPANY | 2004-07-22 | — | — | US | disclosed |