⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5040696 | 1.00 | — | — | |
| SCHEMBL5050328 | 0.76 | — | — | |
| SCHEMBL3647422 | 0.76 | — | — | |
| SCHEMBL28637073 | 0.73 | LMNA (0.44) | — | |
| SCHEMBL1385740 | 0.73 | LMNA (0.44) | — | |
| SCHEMBL1385739 | 0.73 | LMNA (0.44) | — | |
| SCHEMBL19474284 | 0.73 | — | — | |
| SCHEMBL6797745 | 0.71 | — | — | |
| SCHEMBL4025607 | 0.71 | — | — | |
| SCHEMBL7741975 | 0.71 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7622540-B2 | Metal carbonate initiator and method for polymerizing isocyanates using the same | GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2009-11-24 | — | — | US | disclosed |
| EP-1882710-B1 | Use of metal enolate initiators for polymerizing isocyanates | KWANGJU INST SCI & TECH (KR) | 2009-11-18 | — | — | EP | disclosed |
| US-7345038-B2 | Pyridyloxymethyl and benzisoxazole azabicyclic derivatives | PFIZER, INC (US) | 2008-03-18 | — | — | US | disclosed |
| US-20080027204-A1 | Metal carbonate initiator and method for polymerizing isocyanates using the same | GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2008-01-31 | — | — | US | disclosed |
| EP-1882710-A1 | Metal carbonate initiator and method for polymerizing isocyanates using the same | Gwangju Institute of Science and Technology (GIST) (KR) | 2008-01-30 | — | — | EP | disclosed |
| EP-1608648-A1 | PYRIDYLOXYMETHYL AND BENZISOXAZOLE AZABICYCLIC DERIVATIVES | Pfizer Products Inc. (US) | 2005-12-28 | — | — | EP | disclosed |
| US-20050026922-A1 | For treating CNS or other disorders, including concurrent treatment of disorders such as schizophrenia and depression; side effect reduction; for example, (7R,9aS)-trans-7-[6-(2,6-Dimethyl-piperidin-1-ylmethyl)-pyridin-2-yloxymethyl]-2-(5-fluoro-benzo[d]isoxazol-3-yl)-octahydro-pyrido[1,2-a]pyrazine | PFIZER INC | 2005-02-03 | — | — | US | disclosed |
| WO-2004081007-A1 | PYRIDYLOXYMETHYL AND BENZISOXAZOLE AZABICYCLIC DERIVATIVES | PFIZER PRODUCTS INC. (US) | 2004-09-23 | — | — | WO | disclosed |
| US-20040034186-A1 | Novel initiator for polymerizing polyisocyanate | KWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY. | 2004-02-19 | — | — | US | disclosed |