⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6051456 | 0.77 | — | — | |
| SCHEMBL4311579 | 0.76 | CYP2C9 (0.33) | — | |
| SCHEMBL14220785 | 0.74 | — | — | |
| SCHEMBL9619930 | 0.72 | — | — | |
| SCHEMBL4318926 | 0.72 | MAPK1 (0.30) | — | |
| SCHEMBL9868986 | 0.72 | — | — | |
| SCHEMBL7202635 | 0.72 | — | — | |
| SCHEMBL11521157 | 0.70 | KDM4E (0.30) | — | |
| SCHEMBL11521162 | 0.70 | RAB9A (0.42) | — | |
| SCHEMBL10405093 | 0.69 | HSD17B10 (0.32) | — |
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-1669351-A2 | Method for preserving quaternary ammonium salt | Tokuyama Corporation (JP) | 2006-06-14 | — | — | EP | disclosed |
| EP-1178043-B1 | METHOD FOR STORING QUATERNARY AMMONIUM SALT | TOKUYAMA CORP (JP) | 2005-12-28 | — | — | EP | disclosed |
| US-6852856-B2 | Method for preserving quaternary ammonium salt | TOKUYAMA CORPORATION (JP) | 2005-02-08 | — | — | US | disclosed |
| EP-1423363-A1 | ORAL ANTIDIABETIC AGENTS | Warner-Lambert Company LLC (US) | 2004-06-02 | — | — | EP | disclosed |
| US-20030153785-A1 | Method for preserving quaternary ammonium salt | TOKUYAMA CORPORATION (JP) | 2003-08-14 | — | — | US | disclosed |
| WO-2003018553-A1 | ORAL ANTIDIABETIC AGENTS | WARNER-LAMBERT COMPANY LLC (US) | 2003-03-06 | — | — | WO | disclosed |
| EP-1178043-A1 | METHOD FOR STORING QUATERNARY AMMONIUM SALT | TOKUYAMA CORPORATION (JP) | 2002-02-06 | — | — | EP | disclosed |