⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6520967 | 0.80 | — | — | |
| SCHEMBL8197326 | 0.78 | — | — | |
| SCHEMBL37987 | 0.76 | ALDH1A1 (1.00) | — | |
| SCHEMBL23865593 | 0.76 | ALDH1A1 (0.47) | — | |
| SCHEMBL8201432 | 0.76 | ALDH1A1 (0.47) | — | |
| SCHEMBL284189 | 0.72 | — | — | |
| Ammonia Solution, Strong SCHEMBL28802926 | 0.72 | ALDH1A1 (0.91) | — | |
| SCHEMBL23045244 | 0.69 | — | — | |
| SCHEMBL23046 | 0.69 | — | — | |
| SCHEMBL8568132 | 0.69 | — | — |
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 53 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4031198-A | PHARMACOLOGY | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1977-06-21 | — | — | US | claimed |
| CN-114075221-B | Substituted heteroaryl compounds, compositions and uses thereof | 广东东阳光药业股份有限公司 | 2024-08-23 | — | — | CN | disclosed |
| US-20230339977-A1 | SUBSTITUTED HETEROARYL COMPOUND, AND COMPOSITION AND APPLICATION THEREOF | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2023-10-26 | — | — | US | disclosed |
| CN-114075221-A | Substituted heteroaryl compounds, compositions and uses thereof | 广东东阳光药业有限公司 | 2022-02-22 | — | — | CN | disclosed |
| CN-108102504-B | Cathode electrophoretic coating for improving yellowing of automotive sealant and preparation method and application thereof | 盐城安诺电泳涂料科技有限公司 | 2021-12-28 | — | — | CN | disclosed |
| EP-2382199-B1 | KETAL AMIDE COMPOUNDS, METHODS OF MAKING, AND APPLICATIONS | GFBIOCHEMICALS LTD (MT) | 2016-11-16 | — | — | EP | disclosed |
| CN-102245588-B | Ketal amide compound, its preparation method and application | SEGETIS, INC. (US) | 2016-05-04 | — | — | CN | disclosed |
| US-20150175568-A1 | KETAL AMIDE COMPOUNDS, METHODS OF MAKING, AND APPLICATIONS | GFBIOCHEMICALS LIMITED (MT) | 2015-06-25 | — | — | US | disclosed |
| US-8969559-B2 | Ketal amide compounds, methods of making, and applications | SEGETIS, INC. (US) | 2015-03-03 | — | — | US | disclosed |
| WO-2014086712-A1 | NEW INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2014-06-12 | — | — | WO | disclosed |
| US-5428033-A | Useful as anti-asthmatic, anti-allergic, anti-inflammatory and cytoprotecyive agents | MERCK FROSST CANADA, INC. (CA) | 1995-06-27 | — | — | US | disclosed |
| US-5374629-A | A triene steroids as anticarcinogenic agents, treating skin disorders | LEO PHARMACEUTICAL PRODUCTS LTD. A/S LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB (DK) | 1994-12-20 | — | — | US | disclosed |
| EP-0522013-B1 | NOVEL VITAMIN D ANALOGUES | LEO PHARM PROD LTD (DK) | 1994-11-23 | — | — | EP | disclosed |
| US-5270324-A | Fluorinated hydroxyalkylquinoline acids as leukotriene antagonists | MERCK FROSST CANADA, INC. (CA) | 1993-12-14 | — | — | US | disclosed |
| EP-0522013-A1 | NOVEL VITAMIN D ANALOGUES. | LEO PHARM PROD LTD (DK) | 1993-01-13 | — | — | EP | disclosed |
| EP-0480716-A1 | Saturated hydroxyalkylquinoline acids as leukotriene antagonists | MERCK FROSST CANADA INC. (CA) | 1992-04-15 | — | — | EP | disclosed |
| EP-0480717-A1 | Unsaturated hydroxyalkylquinoline acids as leukotriene antagonists | MERCK FROSST CANADA INC. (CA) | 1992-04-15 | — | — | EP | disclosed |
| WO-1991015475-A1 | NOVEL VITAMIN D ANALOGUES | Leo Pharmaceutical Products Ltd. A/S (Løvens Kemiske Fabrik Produktionsaktieselskab) (DK) | 1991-10-17 | — | — | WO | disclosed |
| US-4054645-A | TECHNETIUM ISOTOPE | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1977-10-18 | — | — | US | disclosed |
| US-4031198-A | PHARMACOLOGY | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1977-06-21 | — | — | US | disclosed |