⚠ 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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL5029629 | 0.83 | FFAR3 (0.37) | — | |
| SCHEMBL27314899 | 0.81 | PTGS1 (0.32) | — | |
| Methacrylic Acid SCHEMBL8011010 | 0.79 | TET2 (0.31) | — | |
| Propionic Acid SCHEMBL5027758 | 0.76 | FFAR3 (0.50) | — | |
| SCHEMBL20477152 | 0.75 | GPR84 (0.38) | — | |
| SCHEMBL20477150 | 0.75 | GPR84 (0.38) | — | |
| Trimethylammonium SCHEMBL1377985 | 0.75 | PTGS1 (0.37) | — | |
| Propane SCHEMBL6470808 | 0.75 | PTGS1 (0.37) | — | |
| Trimethylammonium SCHEMBL1377988 | 0.75 | PTGS1 (0.37) | — | |
| SCHEMBL4590681 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0538716-B1 | Photosensitive polyimide precursor formulation | IBM (US) | 1998-02-25 | — | — | EP | claimed |
| EP-0538716-A1 | Photosensitive polyimide precursor formulation | International Business Machines Corporation (US) | 1993-04-28 | — | — | EP | claimed |
| EP-0538716-B1 | Photosensitive polyimide precursor formulation | IBM (US) | 1998-02-25 | — | — | EP | disclosed |
| EP-0538716-A1 | Photosensitive polyimide precursor formulation | International Business Machines Corporation (US) | 1993-04-28 | — | — | EP | disclosed |