⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6657041 | 0.80 | — | — | |
| SCHEMBL6746308 | 0.72 | — | — | |
| SCHEMBL6662391 | 0.69 | — | — | |
| SCHEMBL6658157 | 0.66 | CETP (0.30) | — | |
| Bromide SCHEMBL6656297 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL6660791 | 0.64 | — | — | |
| SCHEMBL5611834 | 0.62 | OPRM1 (0.42) | — | |
| SCHEMBL23123309 | 0.61 | GPR84 (0.39) | — | |
| Bromide SCHEMBL6662848 | 0.61 | ALDH1A1 (0.38) | — | |
| SCHEMBL11814650 | 0.61 | OPRM1 (0.42) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1160267-B1 | CATALYST FOR OXIDATIVE POLYMERIZATION OF FLUOROPHENOL, METHOD OF OXIDATIVE POLYMERIZATION OF FLUOROPHENOL, AND POLY(OXYFLUOROPHENYLENE) DERIVATIVE | JAPAN SCIENCE & TECH CORP (JP) | 2004-08-04 | — | — | EP | disclosed |