⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL594003 | 0.87 | ALDH1A1 (0.35) | — | |
| SCHEMBL9244277 | 0.87 | ALDH1A1 (0.35) | — | |
| SCHEMBL594846 | 0.87 | ALDH1A1 (0.35) | — | |
| SCHEMBL7539964 | 0.87 | ALDH1A1 (0.35) | — | |
| SCHEMBL500083 | 0.85 | ALDH1A1 (0.31) | — | |
| SCHEMBL30869793 | 0.83 | ALDH1A1 (0.32) | — | |
| SCHEMBL20543476 | 0.82 | ALDH1A1 (0.30) | — | |
| SCHEMBL20553568 | 0.82 | ALDH1A1 (0.30) | — | |
| SCHEMBL29986448 | 0.82 | ALDH1A1 (0.30) | — | |
| SCHEMBL28701401 | 0.82 | 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5476934-A | Oxidation a nitrogen-containing perfluoroacyl halide | AGENCY OF INDUSTRIAL SCIENCE & TECHNOLOGY, MINISTRY OF INTERNATIONAL TRADE & INDUSTRY (JP) | 1995-12-19 | — | — | US | disclosed |
| US-5380844-A | Nitrogen-containing perfluoroalkanoyl peroxide and method for production thereof | AGENCY OF INDUSTRIAL SCIENCE & TECHNOLOGY, MINISTRY OF INTERNATIONAL TRADE & INDUSTRY (JP) | 1995-01-10 | — | — | US | disclosed |
| US-5347002-A | Nitrogen-containing perfluoroalkanoyl peroxide and method for production thereof | AGENCY OF INDUSTRIAL SCIENCE & TECHNOLOGY (JP) | 1994-09-13 | — | — | US | disclosed |
| US-5256825-A | Promoter for fluoropolymer, heat exchanging | AGENCY OF INDUSTRIAL SCIENCE & TECHNOLOGY (JP) | 1993-10-26 | — | — | US | disclosed |
| US-5208339-A | Nitrogen-containing perfluoroalkanoyl peroxide and method for production thereof | AGENCY OF INDUSTRIAL SCIENCE & TECHNOLOGY (JP) | 1993-05-04 | — | — | US | disclosed |