⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3315809 | 1.00 | — | — | |
| SCHEMBL15473 | 1.00 | — | — | |
| Methyl Alcohol SCHEMBL28572930 | 0.98 | — | — | |
| SCHEMBL3833627 | 0.89 | QPCT (0.32) | — | |
| SCHEMBL3827554 | 0.89 | QPCT (0.32) | — | |
| SCHEMBL3683539 | 0.89 | QPCT (0.32) | — | |
| SCHEMBL2058199 | 0.83 | — | — | |
| SCHEMBL16090808 | 0.83 | — | — | |
| Tert-Butyl Formate SCHEMBL28095476 | 0.82 | TDP1 (0.35) | — | |
| SCHEMBL18705797 | 0.82 | TAAR1 (0.37) | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2013208-B1 | PYRIDIN[3,4-B]PYRAZINONES | PFIZER PROD INC (US) | 2011-06-22 | — | — | EP | disclosed |
| US-7902195-B2 | Pyridine [3,4-b] pyrazinones | PHARMACIA & UPJOHN COMPANY LLC (US) | 2011-03-08 | — | — | US | disclosed |
| US-20090312310-A1 | Imidazothiazole derivatives | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2009-12-17 | — | — | US | disclosed |
| US-20090312310-A1 | Imidazothiazole derivatives | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2009-12-17 | — | — | US | disclosed |
| US-20090312310-A1 | Imidazothiazole derivatives | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2009-12-17 | — | — | US | disclosed |
| EP-2103619-A1 | IMIDAZOTHIAZOLE DERIVATIVES | Daiichi Sankyo Company, Limited (JP) | 2009-09-23 | — | — | EP | disclosed |
| CN-101454320-A | Pyridine[3,4-b]pyrazinones | PFIZER PROD INC (US) | 2009-06-10 | — | — | CN | disclosed |
| EP-2013208-A1 | PYRIDIN[3,4-B]PYRAZINONES | Pfizer Products Inc. (US) | 2009-01-14 | — | — | EP | disclosed |
| WO-2007122466-A1 | PYRIDINE[3,4-B]PYRAZINONES | PFIZER PRODUCTS INC. (US) | 2007-11-01 | — | — | WO | disclosed |
| US-20070249615-A1 | Pyridine [3,4-b] Pyrazinones | PFIZER INC | 2007-10-25 | — | — | US | disclosed |
| CN-1950358-A | Novel gamma secretase inhibitors | SCHERING CORP (US) | 2007-04-18 | — | — | CN | disclosed |
| EP-1740570-A2 | NOVEL GAMMA SECRETASE INHIBITORS | SCHERING CORPORATION (US) | 2007-01-10 | — | — | EP | disclosed |
| WO-2005097768-A2 | NOVEL GAMMA SECRETASE INHIBITORS | SCHERING CORPORATION (US) | 2005-10-20 | — | — | WO | disclosed |