⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13699269 | 0.73 | — | — | |
| SCHEMBL23837064 | 0.69 | — | — | |
| SCHEMBL22197274 | 0.69 | — | — | |
| SCHEMBL20074784 | 0.69 | — | — | |
| SCHEMBL28654382 | 0.69 | — | — | |
| SCHEMBL16078889 | 0.69 | — | — | |
| SCHEMBL10098665 | 0.65 | — | — | |
| SCHEMBL13350792 | 0.65 | — | — | |
| SCHEMBL18870688 | 0.63 | — | — | |
| SCHEMBL23031942 | 0.60 | — | — |
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-3661898-B1 | PROCESS FOR DEOXYFLUORINATION OF PHENOLS | STUDIENGESELLSCHAFT KOHLE MBH (DE) | 2022-02-23 | — | — | EP | disclosed |