⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL182363 | 0.94 | — | — | |
| SCHEMBL330044 | 0.89 | — | — | |
| SCHEMBL11938182 | 0.78 | — | — | |
| SCHEMBL2920221 | 0.73 | — | — | |
| SCHEMBL2355725 | 0.69 | — | — | |
| SCHEMBL1172393 | 0.68 | TSHR (0.44) | — | |
| SCHEMBL448796 | 0.68 | TSHR (0.44) | — | |
| SCHEMBL29631558 | 0.68 | TSHR (0.44) | — | |
| SCHEMBL5566492 | 0.66 | — | — | |
| SCHEMBL182197 | 0.65 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5111327-A | Substituted 3,4-polymethylenedioxythiophenes, and polymers and electro responsive devices made therefrom | GENERAL ELECTRIC COMPANY (US) | 1992-05-05 | — | — | US | claimed |
| US-7307276-B2 | Layer configuration comprising an electron-blocking element | AGFA-GEVAERT (BE) | 2007-12-11 | — | — | US | disclosed |
| US-6977390-B2 | Layer configuration comprising an electron-blocking element | AGFA GEVAERT (BE) | 2005-12-20 | — | — | US | disclosed |
| US-20040040594-A1 | Layer configuration comprising an electron-blocking element | AGFA-GEVAERT (BE) | 2004-03-04 | — | — | US | disclosed |
| US-20040036067-A1 | Layer configuration comprising an electron-blocking element | AGFA-GEVAERT (BE) | 2004-02-26 | — | — | US | disclosed |