⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13038619 | 1.00 | — | — | |
| SCHEMBL20537141 | 1.00 | — | — | |
| SCHEMBL3682317 | 0.82 | — | — | |
| SCHEMBL3682318 | 0.82 | — | — | |
| SCHEMBL23851806 | 0.81 | — | — | |
| SCHEMBL20536681 | 0.79 | — | — | |
| SCHEMBL24297265 | 0.76 | — | — | |
| SCHEMBL872768 | 0.73 | THRB (0.35) | — | |
| SCHEMBL872769 | 0.73 | THRB (0.35) | — | |
| SCHEMBL31105954 | 0.71 | CNR1 (0.32) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3885334-B1 | PROCESS FOR PREPARING A FORMYLALKENYL ALKOXYMETHYL ETHER COMPOUND AND PROCESSES FOR PREPARING CONJUGATED DIENE COMPOUNDS FROM THE SAME | SHINETSU CHEMICAL CO (JP) | 2023-01-11 | — | — | EP | disclosed |
| US-11420919-B2 | Process for preparing a formylalkenyl alkoxymethyl ether compound and processes for preparing conjugated diene compounds from the same | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2022-08-23 | — | — | US | disclosed |
| US-20210300854-A1 | PROCESS FOR PREPARING A FORMYLALKENYL ALKOXYMETHYL ETHER COMPOUND AND PROCESSES FOR PREPARING CONJUGATED DIENE COMPOUNDS FROM THE SAME | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2021-09-30 | — | — | US | disclosed |
| EP-3885334-A1 | PROCESS FOR PREPARING A FORMYLALKENYL ALKOXYMETHYL ETHER COMPOUND AND PROCESSES FOR PREPARING CONJUGATED DIENE COMPOUNDS FROM THE SAME | Shin-Etsu Chemical Co., Ltd. (JP) | 2021-09-29 | — | — | EP | 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 |
| 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 |