⚠ 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 | |
|---|---|---|---|---|
| Benzene SCHEMBL7646298 | 0.76 | — | — | |
| SCHEMBL13069964 | 0.69 | — | — | |
| SCHEMBL8297078 | 0.69 | — | — | |
| SCHEMBL10813294 | 0.69 | — | — | |
| SCHEMBL14035432 | 0.69 | — | — | |
| SCHEMBL1835091 | 0.68 | — | — | |
| SCHEMBL13480133 | 0.66 | — | — | |
| SCHEMBL17655994 | 0.64 | — | — | |
| SCHEMBL18902789 | 0.63 | — | — | |
| SCHEMBL19432032 | 0.60 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7915274-B2 | Nitrogen containing heterocyclic compounds and medicines containing the same | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2011-03-29 | — | — | US | disclosed |
| EP-1862458-B1 | Therapeutic agents useful for treating pain | EURO CELTIQUE SA (LU) | 2008-11-05 | — | — | EP | disclosed |
| US-20070293496-A1 | Nitrogen containing heterocyclic compounds and medicines containing the same | OZAKI FUMIHIRO | 2007-12-20 | — | — | US | disclosed |
| EP-1862458-A2 | Therapeutic agents useful for treating pain | EURO-CELTIQUE S.A. (LU) | 2007-12-05 | — | — | EP | disclosed |
| WO-2007107543-A1 | INHIBITORS OF THE INTERACTION BETWEEN MDM2 AND P53 | JANSSEN PHARMACEUTICA N.V. (BE) | 2007-09-27 | — | — | WO | disclosed |
| US-7265108-B2 | Nitrogen containing heterocyclic compounds and medicines containing the same | EISAI CO., LTD. (JP) | 2007-09-04 | — | — | US | disclosed |
| EP-1631285-B1 | THERAPEUTIC AGENTS USEFUL FOR TREATING PAIN | EURO CELTIQUE SA (LU) | 2007-08-08 | — | — | EP | disclosed |
| WO-2005004866-A1 | THERAPEUTIC AGENTS USEFUL FOR TREATING PAIN | EURO-CELTIQUE, S.A. (LU) | 2005-01-20 | — | — | WO | disclosed |