⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3250426 | 0.74 | TSHR (0.32) | — | |
| SCHEMBL28644637 | 0.74 | — | — | |
| SCHEMBL5028789 | 0.70 | — | — | |
| SCHEMBL10400500 | 0.70 | — | — | |
| SCHEMBL21700271 | 0.69 | — | — | |
| SCHEMBL331406 | 0.69 | — | — | |
| SCHEMBL4821004 | 0.69 | — | — | |
| SCHEMBL3541800 | 0.67 | — | — | |
| SCHEMBL435550 | 0.67 | MAPK1 (0.38) | — | |
| SCHEMBL24774685 | 0.67 | — | — |
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-0265853-A2 | Process for the manufacture of perfluoroalkylethylallylethers | HOECHST AKTIENGESELLSCHAFT (DE) | 1988-05-04 | — | — | EP | disclosed |