⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL98083 | 0.83 | — | — | |
| SCHEMBL27753257 | 0.81 | NOS3 (0.31) | — | |
| SCHEMBL10888358 | 0.81 | NOS3 (0.33) | — | |
| SCHEMBL10888364 | 0.81 | NOS3 (0.33) | — | |
| SCHEMBL7746242 | 0.81 | — | — | |
| SCHEMBL8359757 | 0.81 | — | — | |
| SCHEMBL7746241 | 0.81 | — | — | |
| SCHEMBL3263258 | 0.80 | ADH1B (0.34) | — | |
| SCHEMBL432351 | 0.78 | — | — | |
| SCHEMBL815076 | 0.78 | NOS1 (0.37) | — |
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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110698334-B | Preparation method of p-tert-butyl benzene propionaldehyde | 格林生物科技股份有限公司 | 2022-07-29 | — | — | CN | disclosed |
| CN-110698334-A | Preparation method of p-tert-butyl benzene propionaldehyde | 格林生物科技股份有限公司 | 2020-01-17 | — | — | CN | disclosed |
| EP-2322495-B1 | Novel 4-alkyl cyclohexanepropanal compounds and their use in perfume compositions | INT FLAVORS & FRAGRANCES INC (US) | 2013-01-02 | — | — | EP | disclosed |
| EP-2322495-B1 | Novel 4-alkyl cyclohexanepropanal compounds and their use in perfume compositions | INT FLAVORS & FRAGRANCES INC (US) | 2013-01-02 | — | — | EP | disclosed |
| EP-2333038-B1 | Novel 4-Alkyl Cyclohexanepropanal Compounds and their use in Perfume Compositions | INT FLAVORS & FRAGRANCES INC (US) | 2012-06-13 | — | — | EP | disclosed |
| US-8188023-B2 | 4-alkyl cyclohexanepropanal compounds and their use in perfume compositions | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2012-05-29 | — | — | US | disclosed |
| US-8188023-B2 | 4-alkyl cyclohexanepropanal compounds and their use in perfume compositions | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2012-05-29 | — | — | US | disclosed |
| US-8188023-B2 | 4-alkyl cyclohexanepropanal compounds and their use in perfume compositions | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2012-05-29 | — | — | US | disclosed |
| US-20110217257-A1 | NOVEL 4-ALKYL CYCLOHEXANEPROPANAL COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS | INTERNATIONAL FLAVORS & FRAGRANCES INC. | 2011-09-08 | — | — | US | disclosed |
| CN-102115434-A | Novel 4-alkyl cyclohexanepropanal compounds and their use in perfume compositions | INT FLAVORS & FRAGRANCES INC | 2011-07-06 | — | — | CN | disclosed |
| CN-102070418-A | Novel 4-alkyl cyclohexanepropanal compounds and their use in perfume compositions | INT FLAVORS & FRAGRANCES INC | 2011-05-25 | — | — | CN | disclosed |
| CN-102070418-A | Novel 4-alkyl cyclohexanepropanal compounds and their use in perfume compositions | INT FLAVORS & FRAGRANCES INC | 2011-05-25 | — | — | CN | disclosed |
| US-20110117046-A1 | NOVEL 4-ALKYL CYCLOHEXANEPROPANAL COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS | INTERNATIONAL FLAVORS & FRAGRANCES INC. | 2011-05-19 | — | — | US | disclosed |
| US-20110117046-A1 | NOVEL 4-ALKYL CYCLOHEXANEPROPANAL COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS | INTERNATIONAL FLAVORS & FRAGRANCES INC. | 2011-05-19 | — | — | US | disclosed |
| EP-2322495-A1 | Novel 4-alkyl cyclohexanepropanal compounds and their use in perfume compositions | International Flavors & Fragrances Inc. (US) | 2011-05-18 | — | — | EP | disclosed |
| EP-2322495-A1 | Novel 4-alkyl cyclohexanepropanal compounds and their use in perfume compositions | International Flavors & Fragrances Inc. (US) | 2011-05-18 | — | — | EP | disclosed |
| EP-2322495-A1 | Novel 4-alkyl cyclohexanepropanal compounds and their use in perfume compositions | International Flavors & Fragrances Inc. (US) | 2011-05-18 | — | — | EP | disclosed |
| US-7834219-B1 | 4-alkyl cyclohexanepropanal compounds and their use in perfume compositions | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2010-11-16 | — | — | US | disclosed |
| US-7834219-B1 | 4-alkyl cyclohexanepropanal compounds and their use in perfume compositions | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2010-11-16 | — | — | US | disclosed |
| US-7834219-B1 | 4-alkyl cyclohexanepropanal compounds and their use in perfume compositions | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2010-11-16 | — | — | US | disclosed |