⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL163320 | 1.00 | — | — | |
| SCHEMBL5573442 | 1.00 | — | — | |
| SCHEMBL9630234 | 1.00 | — | — | |
| SCHEMBL51137 | 1.00 | — | — | |
| SCHEMBL26754336 | 1.00 | — | — | |
| SCHEMBL23231188 | 0.97 | ALDH1A1 (0.46) | — | |
| SCHEMBL11589442 | 0.97 | ALDH1A1 (0.46) | — | |
| SCHEMBL17010813 | 0.97 | ALDH1A1 (0.46) | — | |
| SCHEMBL2019383 | 0.97 | ALDH1A1 (0.46) | — | |
| SCHEMBL11796515 | 0.97 | ALDH1A1 (0.46) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1754693-A1 | Process for the production of esters or lactones, and process for the production of peroxides | Daicel Chemical Industries, Ltd. (JP) | 2007-02-21 | — | — | EP | disclosed |
| EP-0990631-B1 | PROCESS FOR COOXIDIZING ORGANIC COMPOUNDS | DAICEL CHEM (JP) | 2007-01-24 | — | — | EP | disclosed |
| US-6229023-B1 | N-OXY OR HYDROXY CYCLIC IMIDE OXIDATION CATALYST | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2001-05-08 | — | — | US | disclosed |
| EP-0990631-A1 | PROCESS FOR COOXIDIZING ORGANIC COMPOUNDS, PROCESS FOR PRODUCING EPOXY COMPOUNDS AND PROCESS FOR PRODUCING ESTERS OR LACTONES | Daicel Chemical Industries, Ltd. (JP) | 2000-04-05 | — | — | EP | disclosed |
| EP-0315247-B1 | PROCESS FOR THE PRODUCTION OF EPOXY DERIVATIVES WITH CIS-CONFIGURATION, BY STARTING FROM MIXTURES OF THE CORRESPONDING OLEFINIC STEREOISOMERS | ENIRICERCHE S.p.A. (IT) | 1992-04-15 | — | — | EP | disclosed |
| EP-0315248-B1 | PREPARATION OF EPOXY COMPOUNDS WITH CIS- AND TRANS-CONFIGURATION, BY STARTING FROM MIXTURES OF THE CORRESPONDING OLEFIN STEREOISOMERS | ENIRICERCHE S.p.A. (IT) | 1992-04-15 | — | — | EP | disclosed |
| EP-0315247-A1 | Process for the production of epoxy derivatives with cis-configuration, by starting from mixtures of the corresponding olefinic stereoisomers | ENIRICERCHE S.p.A. (IT) | 1989-05-10 | — | — | EP | disclosed |