⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16505751 | 1.00 | — | — | |
| SCHEMBL11455768 | 0.77 | PTPN1 (0.32) | — | |
| SCHEMBL11455767 | 0.77 | PTPN1 (0.32) | — | |
| SCHEMBL2645938 | 0.76 | — | — | |
| SCHEMBL13971139 | 0.76 | — | — | |
| SCHEMBL6039939 | 0.74 | — | — | |
| SCHEMBL13947223 | 0.74 | — | — | |
| SCHEMBL11868333 | 0.74 | ALDH1A1 (0.32) | — | |
| SCHEMBL2162965 | 0.74 | — | — | |
| SCHEMBL18475663 | 0.74 | — | — |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9758467-B2 | Organoleptic compounds | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2017-09-12 | — | — | US | claimed |
| US-20160160153-A1 | NOVEL ORGANOLEPTIC COMPOUNDS | INT FLAVORS & FRAGRANCES INC (US) | 2016-06-09 | — | — | US | claimed |
| US-20150057207-A1 | NOVEL ORGANOLEPTIC COMPOUNDS | INTERNATIONAL FLAVORS & FRAGRANCES INC. | 2015-02-26 | — | — | US | claimed |
| CN-106010788-B | Novel aldehyde compounds and their use in perfuming compositions | 国际香料和香精公司 | 2021-04-23 | — | — | CN | disclosed |
| US-10150722-B2 | Aldehyde compounds and their use in perfume compositions | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2018-12-11 | — | — | US | disclosed |
| EP-3072876-B1 | ALDEHYDE COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS | INT FLAVORS & FRAGRANCES INC (US) | 2018-10-10 | — | — | EP | disclosed |
| US-20180057436-A1 | NOVEL ALDEHYDE COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS | INTERNATIONAL FLAVORS & FRAGRANCES INC. | 2018-03-01 | — | — | US | disclosed |
| US-9850191-B2 | Aldehyde compounds and their use in perfume compositions | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2017-12-26 | — | — | US | disclosed |
| US-9758467-B2 | Organoleptic compounds | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2017-09-12 | — | — | US | disclosed |
| US-9643913-B2 | Organoleptic compounds | INTERNATIONAL FLAVORS & FRAGRANCES (US) | 2017-05-09 | — | — | US | disclosed |
| US-20160340291-A1 | NOVEL ORGANOLEPTIC COMPOUNDS | INT FLAVORS & FRAGRANCES INC (US) | 2016-11-24 | — | — | US | disclosed |
| US-20160281027-A1 | NOVEL ALDEHYDE COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS | INTERNATIONAL FLAVORS & FRAGRANCES INC. | 2016-09-29 | — | — | US | disclosed |
| EP-3072876-A1 | ALDEHYDE COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS | Closson, Adam P. (US) | 2016-09-28 | — | — | EP | disclosed |
| US-20160160153-A1 | NOVEL ORGANOLEPTIC COMPOUNDS | INT FLAVORS & FRAGRANCES INC (US) | 2016-06-09 | — | — | US | disclosed |
| US-9289366-B2 | Organoleptic compounds | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2016-03-22 | — | — | US | disclosed |
| US-20150057207-A1 | NOVEL ORGANOLEPTIC COMPOUNDS | INTERNATIONAL FLAVORS & FRAGRANCES INC. | 2015-02-26 | — | — | US | disclosed |