⚠ 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 | |
|---|---|---|---|---|
| Pentanal SCHEMBL28721 | 0.97 | — | — | |
| Pentanal SCHEMBL622584 | 0.97 | TSHR (1.00) | — | |
| Pentanal SCHEMBL5172697 | 0.93 | — | — | |
| Pentanal SCHEMBL1628430 | 0.93 | — | — | |
| Pentanal SCHEMBL11299036 | 0.93 | — | — | |
| Pentanal SCHEMBL11434933 | 0.93 | — | — | |
| Pentanal SCHEMBL7624050 | 0.93 | — | — | |
| Pentanal SCHEMBL3801508 | 0.93 | — | — | |
| Pentanal SCHEMBL24385 | 0.93 | — | — | |
| Pentanal SCHEMBL4581160 | 0.93 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2125806-A1 | COMPOUNDS HAVING BOTH ANGIOTENSIN II RECEPTOR ANTAGONISM AND PPARY ACTIVATING ACTIVITIES | Pfizer Products Inc. (US) | 2009-12-02 | — | — | EP | disclosed |
| WO-2008084303-A1 | COMPOUNDS HAVING BOTH ANGIOTENSIN II RECEPTOR ANTAGONISM AND PPARY ACTIVATING ACTIVITIES | PFIZER PRODUCTS INC. (US) | 2008-07-17 | — | — | WO | disclosed |