⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9561528 | 1.00 | — | — | |
| SCHEMBL9547733 | 1.00 | — | — | |
| SCHEMBL10381197 | 0.73 | — | — | |
| SCHEMBL10381198 | 0.73 | — | — | |
| SCHEMBL20780468 | 0.68 | — | — | |
| SCHEMBL9547838 | 0.67 | — | — | |
| SCHEMBL19711807 | 0.65 | — | — | |
| SCHEMBL29059069 | 0.65 | TSHR (0.33) | — | |
| SCHEMBL11447682 | 0.64 | LMNA (0.41) | — | |
| SCHEMBL10492406 | 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0404748-B1 | NOVEL STEREOISOMERS | AKTIEBOLAGET HÄSSLE (SE) | 1993-04-28 | — | — | EP | disclosed |
| EP-0404747-B1 | NOVEL POLYSTYRENESULFONATE | AKTIEBOLAGET HÄSSLE (SE) | 1993-04-21 | — | — | EP | disclosed |
| US-5068272-A | NOVEL POLYSTYRENESULFONATE, USEFUL AGAINST CARDIAC ARRHYTHMIAS | AKTIEBOLAGET HASSLE (SE) | 1991-11-26 | — | — | US | disclosed |
| US-5055490-A | STEREOISOMERS OF BENZONITRILE DERIVATIVES, USEFUL AS CARDIAC ARRHYTHMIAC AGENTS | AKTIEBOLAGET HASSLE (SE) | 1991-10-08 | — | — | US | disclosed |
| WO-1990015794-A1 | NOVEL STEREOISOMERS | Aktiebolaget Hässle (SE) | 1990-12-27 | — | — | WO | disclosed |