⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8788695 | 1.00 | — | — | |
| SCHEMBL8323892 | 0.83 | ALDH1A1 (0.47) | — | |
| SCHEMBL8855099 | 0.83 | ALDH1A1 (0.47) | — | |
| SCHEMBL9750815 | 0.73 | — | — | |
| SCHEMBL13185853 | 0.71 | — | — | |
| SCHEMBL374799 | 0.71 | — | — | |
| SCHEMBL13864359 | 0.71 | — | — | |
| SCHEMBL9756813 | 0.71 | — | — | |
| SCHEMBL672582 | 0.69 | TSHR (0.34) | — | |
| SCHEMBL9540495 | 0.69 | ALDH1A1 (0.30) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0668256-B1 | Process for preparing a water-soluble organic oxide | COSMO SOGO KENKYUSHO KK (JP) | 1997-10-15 | — | — | EP | disclosed |
| US-5554766-A | OXIATION | COSMO RESEARCH INSTITUTE (JP) | 1996-09-10 | — | — | US | disclosed |
| EP-0668256-A1 | Process for preparing water-soluble organic oxides such as 5-aminolevulinic acid | COSMO RESEARCH INSTITUTE (JP) | 1995-08-23 | — | — | EP | disclosed |
| US-5157087-A | Organic peroxides and their use in the preparation of epoxide groups-containing (co)polymers | AKZO N.V. (NL) | 1992-10-20 | — | — | US | disclosed |
| EP-0273990-B1 | NOVEL ORGANIC PEROXIDES AND THEIR USE IN THE PREPARATION OF EPOXIDE GROUPS CONTAINING (CO)POLYMERS | AKZO N.V. (NL) | 1991-09-18 | — | — | EP | disclosed |
| EP-0219900-B1 | T-ALKENYL PEROXY ESTERS AND THEIR USE AS INITIATORS AND CURING AGENTS | AKZO N.V. (NL) | 1990-09-12 | — | — | EP | disclosed |
| US-4837287-A | COPOLYMERIZATION OF ETHYLENICALLY UNSATURATED COMPOUNDS | AKZO N.V. (NL) | 1989-06-06 | — | — | US | disclosed |
| EP-0273990-A1 | Novel organic peroxides and their use in the preparation of epoxide groups containing (co)polymers | AKZO N.V. (NL) | 1988-07-13 | — | — | EP | disclosed |
| US-4705888-A | POLYMERIZATION CATALYSTS | AKZO NV (NL) | 1987-11-10 | — | — | US | disclosed |
| EP-0219900-A1 | T-Alkenyl peroxy esters and their use as initiators and curing agents | AKZO N.V. (NL) | 1987-04-29 | — | — | EP | disclosed |