⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28499471 | 1.00 | — | — | |
| SCHEMBL28511114 | 1.00 | — | — | |
| Acetic Acid SCHEMBL22607985 | 0.92 | — | — | |
| Acetic Acid SCHEMBL592986 | 0.92 | — | — | |
| SCHEMBL22897361 | 0.81 | — | — | |
| SCHEMBL13784904 | 0.78 | — | — | |
| SCHEMBL592985 | 0.74 | ALDH1A1 (0.32) | — | |
| SCHEMBL1301519 | 0.74 | ALDH1A1 (0.32) | — | |
| SCHEMBL13784902 | 0.74 | — | — | |
| SCHEMBL28507386 | 0.72 | ATM (0.33) | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112239398-B | Dimethylcyclobutanone compound, dimethylcyclobutane compound and preparation methods thereof | 信越化学工业株式会社 | 2024-07-30 | — | — | CN | disclosed |
| CN-112239407-B | Diester compound having dimethylcyclobutane ring, method for producing the same, and method for producing dimethylcyclobutane compound derived from the same | 信越化学工业株式会社 | 2024-05-28 | — | — | CN | disclosed |
| EP-3766862-B1 | DIMETHYLCYCLOBUTANONE COMPOUNDS, DIMETHYLCYCLOBUTANE COMPOUNDS, AND PROCESSES FOR PREPARING THE SAME | SHINETSU CHEMICAL CO (JP) | 2023-06-07 | — | — | EP | disclosed |
| US-20220324783-A1 | DIMETHYLCYCLOBUTANONE COMPOUNDS, DIMETHYLCYCLOBUTANE COMPOUNDS, AND PROCESSES FOR PREPARING THE SAME | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2022-10-13 | — | — | US | disclosed |
| US-20220259136-A1 | DIESTER COMPOUND HAVING A DIMETHYLCYCLOBUTANE RING, A PROCESS FOR PREPARING THE SAME, AND A PROCESS FOR PREPARING DIMETHYLCYCLOBUTANE COMPOUND DERIVED FROM THE DIESTER COMPOUND | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2022-08-18 | — | — | US | disclosed |
| US-11384043-B2 | Dimethylcyclobutanone compounds, dimethylcyclobutane compounds, and processes for preparing the same | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2022-07-12 | — | — | US | disclosed |
| US-11352312-B2 | Diester compound having a dimethylcyclobutane ring, a process for preparing the same, and a process for preparing dimethylcyclobutane compound derived from the diester compound | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2022-06-07 | — | — | US | disclosed |
| US-20210017115-A1 | DIESTER COMPOUND HAVING A DIMETHYLCYCLOBUTANE RING, A PROCESS FOR PREPARING THE SAME, AND A PROCESS FOR PREPARING DIMETHYLCYCLOBUTANE COMPOUND DERIVED FROM THE DIESTER COMPOUND | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2021-01-21 | — | — | US | disclosed |
| US-20210017112-A1 | DIMETHYLCYCLOBUTANONE COMPOUNDS, DIMETHYLCYCLOBUTANE COMPOUNDS, AND PROCESSES FOR PREPARING THE SAME | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2021-01-21 | — | — | US | disclosed |
| EP-3766862-A1 | DIMETHYLCYCLOBUTANONE COMPOUNDS, DIMETHYLCYCLOBUTANE COMPOUNDS, AND PROCESSES FOR PREPARING THE SAME | Shin-Etsu Chemical Co., Ltd. (JP) | 2021-01-20 | — | — | EP | disclosed |
| CN-112239398-A | Dimethylcyclobutanone compound, dimethylcyclobutane compound and preparation method thereof | 信越化学工业株式会社 | 2021-01-19 | — | — | CN | disclosed |
| CN-112239407-A | Diester compound having dimethylcyclobutane ring, process for producing the same, and process for producing dimethylcyclobutane compound derived therefrom | 信越化学工业株式会社 | 2021-01-19 | — | — | CN | disclosed |