⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14777706 | 0.90 | — | — | |
| SCHEMBL9505476 | 0.78 | ALDH1A1 (0.37) | — | |
| SCHEMBL2967255 | 0.76 | — | — | |
| SCHEMBL3668650 | 0.75 | MEN1 (0.38) | — | |
| SCHEMBL10978131 | 0.74 | — | — | |
| SCHEMBL18212306 | 0.74 | GSR (0.31) | — | |
| SCHEMBL1667495 | 0.74 | LMNA (0.42) | — | |
| SCHEMBL10530185 | 0.69 | ALDH1A1 (0.32) | — | |
| SCHEMBL3730701 | 0.69 | ALDH1A1 (0.32) | — | |
| SCHEMBL2077719 | 0.69 | LMNA (0.32) | — |
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-8703800-B2 | Nitrate and diazeniumdiolate derivatives of pioglitazone | CARDIOLYNX AG (CH) | 2014-04-22 | — | — | US | disclosed |
| EP-2576545-A1 | NITRATE AND DIAZENIUMDIOLATE DERIVATIVES OF PIOGLITAZONE | Cardiolynx AG (CH) | 2013-04-10 | — | — | EP | disclosed |
| US-20130072525-A1 | NITRATE AND DIAZENIUMDIOLATE DERIVATIVES OF PIOGLITAZONE | CARDIOLYNX AG (CH) | 2013-03-21 | — | — | US | disclosed |
| WO-2011151362-A1 | NITRATE AND DIAZENIUMDIOLATE DERIVATIVES OF PIOGLITAZONE | CARDIOLYNX AG (CH) | 2011-12-08 | — | — | WO | disclosed |