⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8427618 | 0.87 | EPHX1 (0.33) | — | |
| SCHEMBL8427619 | 0.78 | EPHX1 (0.33) | — | |
| SCHEMBL9418653 | 0.77 | EPHX1 (0.32) | — | |
| SCHEMBL24277 | 0.74 | TSHR (0.37) | — | |
| SCHEMBL6571613 | 0.73 | EPHX1 (0.32) | — | |
| SCHEMBL19206705 | 0.72 | EPHX1 (0.35) | — | |
| SCHEMBL95094 | 0.71 | TSHR (0.34) | — | |
| SCHEMBL6509002 | 0.69 | EPHX1 (0.34) | — | |
| SCHEMBL16732014 | 0.69 | EPHX1 (0.33) | — | |
| SCHEMBL2382305 | 0.69 | ABCB1 (0.35) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-6228087-A | — | — | None | — | — | JP | disclosed |
| EP-0610016-B2 | 1-Cyclohexyl-1-methylethylperoxy carbonates, method for production thereof, and uses therefor | NOF CORP (JP) | 1999-10-20 | — | — | EP | disclosed |
| US-5446191-A | Polymerization initiator for vinyl monomer, curing agent for unsaturated polyester | NOF CORPORATION (JP) | 1995-08-29 | — | — | US | disclosed |
| JP-H06228087-A | 1-CYCLOHEXYL-1-METHYLETHYL-PEROXYCARBONATE AND ITS PRODUCTION AND USE | NIPPON OIL & FATS CO LTD | 1994-08-16 | — | — | JP | disclosed |
| EP-0610016-A1 | 1-Cyclohexyl-1-methylethylperoxy carbonates, method for production thereof, and uses therefor | NOF CORPORATION (JP) | 1994-08-10 | — | — | EP | disclosed |