⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19467 | 0.68 | — | — | |
| SCHEMBL291467 | 0.66 | — | — | |
| SCHEMBL305863 | 0.64 | — | — | |
| SCHEMBL7994772 | 0.64 | — | — | |
| SCHEMBL131288 | 0.64 | — | — | |
| SCHEMBL16701052 | 0.64 | — | — | |
| SCHEMBL1190952 | 0.64 | — | — | |
| SCHEMBL7965356 | 0.64 | — | — | |
| SCHEMBL9486409 | 0.64 | — | — | |
| SCHEMBL5075200 | 0.64 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0114576-B1 | PERFLUOROALKYL-ALKYLENE BRANCHED AMPHOTERIC SULFATO BETAINES | CIBA-GEIGY AG (CH) | 1987-04-22 | — | — | EP | disclosed |
| EP-0114576-A2 | Perfluoroalkyl-alkylene branched amphoteric sulfato betaines | CIBA-GEIGY AG (CH) | 1984-08-01 | — | — | EP | disclosed |