⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3084320 | 0.67 | — | — | |
| SCHEMBL8998510 | 0.67 | — | — | |
| SCHEMBL10522666 | 0.67 | — | — | |
| SCHEMBL780071 | 0.67 | — | — | |
| SCHEMBL36478 | 0.67 | — | — | |
| SCHEMBL10891152 | 0.64 | — | — | |
| SCHEMBL978315 | 0.64 | ALDH1A1 (0.52) | — | |
| SCHEMBL11171956 | 0.64 | — | — | |
| SCHEMBL11294838 | 0.64 | — | — | |
| SCHEMBL31069838 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7879826-B2 | N-methyl-D-aspartate (NMDA) receptor antagonists, such as Diethyl 3,3'-[({2-[8,9-dioxo-2,6-diazabicyclo[5.2.0]non-1(7)-en-2-yl]ethyl}phosphoryl)bis(oxy)]dibenzoate, used for treating pain in a mammals; analgesics | WYETH LLC (US) | 2011-02-01 | — | — | US | disclosed |
| EP-1797104-B1 | DERIVATIVES OF [2-(8,9-DIOXO-2,6-DIAZABICYCLO[5.2.0]NON-1(7)-EN-2-YL)ALKYL]PHOSPHONIC ACID AND METHOD OF MAKING THEM | WYETH CORP (US) | 2009-11-25 | — | — | EP | disclosed |
| US-20070244100-A1 | Derivatives of [2-(8,9-Dioxo-2,6-diazabicyclo[5.2.0]non-1(7)-en-2-yl)alkyl]phosphonic Acid and Methods of Making Them | WYETH (US) | 2007-10-18 | — | — | US | disclosed |
| US-7268123-B2 | Derivatives of [2-(8,9-dioxo-2,6-diazabicyclo[5.2.0]non-1(7)-en-2-yl)alkyl]phosphonic acid and methods of making them | WYETH (US) | 2007-09-11 | — | — | US | disclosed |
| EP-1797104-A1 | DERIVATIVES OF [2-(8,9-DIOXO-2,6-DIAZABICYCLO[5.2.0]NON-1(7)-EN-2-YL)ALKYL]PHOSPHONIC ACID AND METHOD OF MAKING THEM | Wyeth (US) | 2007-06-20 | — | — | EP | disclosed |
| WO-2006041975-A1 | DERIVATIVES OF [2-(8,9-DIOXO-2,6-DIAZABICYCLO[5.2.0]NON-1(7)-EN-2-YL)ALKYL]PHOSPHONIC ACID AND METHOD OF MAKING THEM | WYETH (US) | 2006-04-20 | — | — | WO | disclosed |
| US-20060079679-A1 | Derivatives of [2-(8,9-dioxo-2,6-diazabicyclo[5.2.0]non-1(7)-en-2-yl)alkyl]phosphonic acid and methods of making them | WYETH (US) | 2006-04-13 | — | — | US | disclosed |