⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28666159 | 1.00 | — | — | |
| SCHEMBL20536664 | 1.00 | — | — | |
| SCHEMBL3682317 | 0.87 | — | — | |
| SCHEMBL3682318 | 0.87 | — | — | |
| SCHEMBL20537132 | 0.78 | — | — | |
| SCHEMBL868995 | 0.77 | — | — | |
| SCHEMBL3366704 | 0.77 | — | — | |
| SCHEMBL21967103 | 0.76 | — | — | |
| SCHEMBL21967116 | 0.76 | — | — | |
| SCHEMBL20536663 | 0.74 | USP2 (0.41) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108727165-B | Process for producing 2, 4-dienal aldehyde compound and 2, 4-dienal compound | 信越化学工业株式会社 | 2021-11-12 | — | — | CN | disclosed |
| EP-3392230-B1 | METHOD FOR PRODUCING 2,4-DIENAL ACETAL COMPOUND AND 2,4-DIENAL COMPOUND | SHINETSU CHEMICAL CO (JP) | 2020-03-04 | — | — | EP | disclosed |
| US-10138179-B2 | Method for producing 2,4-dienal acetal compound and 2,4-dienal compound | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2018-11-27 | — | — | US | disclosed |
| CN-108727165-A | The method for preparing 2,4- bis- olefine aldehydr acetal compounds and 2,4- diene aldehyde compounds | 信越化学工业株式会社 | 2018-11-02 | — | — | CN | disclosed |
| US-20180305276-A1 | METHOD FOR PRODUCING 2,4-DIENAL ACETAL COMPOUND AND 2,4-DIENAL COMPOUND | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2018-10-25 | — | — | US | disclosed |
| EP-3392230-A1 | METHOD FOR PRODUCING 2,4-DIENAL ACETAL COMPOUND AND 2,4-DIENAL COMPOUND | Shin-Etsu Chemical Co., Ltd. (JP) | 2018-10-24 | — | — | EP | disclosed |