⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7093118 | 0.96 | SHBG (0.32) | — | |
| SCHEMBL5542322 | 0.87 | — | — | |
| SCHEMBL5545142 | 0.82 | SHBG (0.37) | — | |
| SCHEMBL5542043 | 0.80 | SHBG (0.41) | — | |
| SCHEMBL11257495 | 0.80 | SHBG (0.41) | — | |
| SCHEMBL20600327 | 0.80 | SHBG (0.41) | — | |
| SCHEMBL5541917 | 0.80 | SHBG (0.41) | — | |
| SCHEMBL5542682 | 0.80 | SHBG (0.41) | — | |
| SCHEMBL26106375 | 0.78 | SHBG (0.39) | — | |
| SCHEMBL6741301 | 0.78 | SHBG (0.30) | — |
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-1301483-A1 | 1-ARYL-4-ALKYL HALIDE-2(1H)-PYRIDONES AND THEIR USE AS HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 2003-04-16 | — | — | EP | disclosed |
| WO-2002006233-A1 | 1-ARYL-4-ALKYL HALIDE-2(1H)-PYRIDONES AND THEIR USE AS HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 2002-01-24 | — | — | WO | disclosed |