⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9940083 | 0.95 | — | — | |
| SCHEMBL9387078 | 0.84 | — | — | |
| SCHEMBL7037518 | 0.78 | — | — | |
| SCHEMBL601730 | 0.76 | — | — | |
| SCHEMBL1593366 | 0.76 | — | — | |
| SCHEMBL5831274 | 0.67 | ALDH1A1 (0.33) | — | |
| SCHEMBL3437109 | 0.67 | — | — | |
| SCHEMBL21060800 | 0.63 | — | — | |
| SCHEMBL1419671 | 0.61 | GABRA1 (0.35) | — | |
| SCHEMBL252057 | 0.61 | GABRA1 (0.35) | — |
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-7919574-B2 | Polymer having thieno[3,2-b] thiophene moieties | XEROX CORPORATION (US) | 2011-04-05 | — | — | US | disclosed |
| US-7919573-B2 | Polymer having thieno[3,2-b] thiophene moieties | XEROX CORPORATION (US) | 2011-04-05 | — | — | US | disclosed |
| US-20090124788-A1 | POLYMER HAVING THIENO[3,2-b] THIOPHENE MOIETIES | XEROX CORPORATION (US) | 2009-05-14 | — | — | US | disclosed |
| US-20070112171-A1 | Polymer having thieno[3,2-b] thiophene moieties statement regarding federally sponsored research or development | XEROX CORPORATION | 2007-05-17 | — | — | US | disclosed |