⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11265137 | 0.95 | NAAA (0.30) | — | |
| SCHEMBL6489254 | 0.90 | — | — | |
| SCHEMBL7051098 | 0.82 | — | — | |
| SCHEMBL304992 | 0.82 | TSHR (0.53) | — | |
| SCHEMBL577753 | 0.82 | TSHR (0.53) | — | |
| SCHEMBL9219931 | 0.82 | TSHR (0.53) | — | |
| SCHEMBL2565171 | 0.82 | TSHR (0.53) | — | |
| SCHEMBL303552 | 0.82 | TSHR (0.53) | — | |
| SCHEMBL9207299 | 0.82 | TSHR (0.53) | — | |
| SCHEMBL5106960 | 0.82 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110288240-A1 | NOVEL PHOSPHAZENE-SUPPORTED CATALYST, NOVEL COMPOUND THEREOF AND USE THEREOF | MITSUI CHEMICALS, INC. (JP) | 2011-11-24 | — | — | US | disclosed |
| EP-1775301-B1 | NOVEL SUPPORTED PHOSPHAZENE CATALYSTS, NOVEL COMPOUNDS FOR THE CATALYSTS, AND USE THEREOF | MITSUI CHEMICALS INC (JP) | 2011-08-10 | — | — | EP | disclosed |
| US-20080318767-A1 | Novel Phosphazene-Supported Catalyst, Novel Compound Thereof and Use Thereof | MITSUI CHEMICALS, INC. (JP) | 2008-12-25 | — | — | US | disclosed |
| EP-1775301-A1 | NOVEL SUPPORTED PHOSPHAZENE CATALYSTS, NOVEL COMPOUNDS FOR THE CATALYSTS, AND USE THEREOF | Mitsui Chemicals Polyurethanes, Inc. (JP) | 2007-04-18 | — | — | EP | disclosed |