⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21829053 | 0.88 | — | — | |
| SCHEMBL1800268 | 0.82 | TSHR (0.32) | — | |
| SCHEMBL1277183 | 0.78 | TSHR (0.40) | — | |
| SCHEMBL10657827 | 0.78 | CES2 (0.34) | — | |
| SCHEMBL418536 | 0.73 | — | — | |
| Butane SCHEMBL5142246 | 0.71 | LMNA (0.31) | — | |
| SCHEMBL62399 | 0.67 | TSHR (0.38) | — | |
| Butane SCHEMBL28456059 | 0.67 | — | — | |
| Butane SCHEMBL31240952 | 0.67 | TSHR (0.33) | — | |
| Butane SCHEMBL3151333 | 0.67 | TSHR (0.33) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1505057-B1 | METHOD OF PURIFYING QUATERNARY ALKYLAMMONIUM SALT | STELLA CHEMIFA KABUSHIKI KAISHA (JP) | 2011-06-22 | — | — | EP | claimed |
| US-20060020147-A1 | Dispersing a quaternary alkyl ammonium salt to be purified into an acetone solvent to form a suspension of salt particles, quaternary alkyl ammonium salt being one of quaternary alkyl ammonium-tetrafluoroborate and quaternary alkyl ammonium-hexafluorophosphate;recovering, washing | STELLA CHEMIFA KABUSHIKI KAISHA (JP) | 2006-01-26 | — | — | US | claimed |
| EP-1505057-A1 | METHOD OF PURIFYING QUATERNARY ALKYLAMMONIUM SALT AND QUATERNARY ALKYLAMMONIUM SALT | Stella Chemifa Kabushiki Kaisha (JP) | 2005-02-09 | — | — | EP | claimed |
| EP-1505057-B1 | METHOD OF PURIFYING QUATERNARY ALKYLAMMONIUM SALT | STELLA CHEMIFA KABUSHIKI KAISHA (JP) | 2011-06-22 | — | — | EP | disclosed |
| US-7268256-B2 | Dispersing a quaternary alkyl ammonium salt to be purified into an acetone solvent to form a suspension of salt particles, quaternary alkyl ammonium salt being one of quaternary alkyl ammonium-tetrafluoroborate and quaternary alkyl ammonium-hexafluorophosphate;recovering, washing | STELLA CHEMIFA KABUSHIKI KAISHA (JP) | 2007-09-11 | — | — | US | disclosed |
| US-20060020147-A1 | Dispersing a quaternary alkyl ammonium salt to be purified into an acetone solvent to form a suspension of salt particles, quaternary alkyl ammonium salt being one of quaternary alkyl ammonium-tetrafluoroborate and quaternary alkyl ammonium-hexafluorophosphate;recovering, washing | STELLA CHEMIFA KABUSHIKI KAISHA (JP) | 2006-01-26 | — | — | US | disclosed |
| EP-1505057-A1 | METHOD OF PURIFYING QUATERNARY ALKYLAMMONIUM SALT AND QUATERNARY ALKYLAMMONIUM SALT | Stella Chemifa Kabushiki Kaisha (JP) | 2005-02-09 | — | — | EP | disclosed |