⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7014384 | 1.00 | — | — | |
| SCHEMBL7019989 | 0.88 | — | — | |
| SCHEMBL7019988 | 0.88 | — | — | |
| SCHEMBL7022213 | 0.80 | BRD4 (0.31) | — | |
| SCHEMBL7022215 | 0.80 | BRD4 (0.31) | — | |
| SCHEMBL7019920 | 0.74 | — | — | |
| SCHEMBL7020738 | 0.73 | — | — | |
| SCHEMBL7020736 | 0.73 | — | — | |
| SCHEMBL7019026 | 0.72 | CYP1A2 (0.32) | — | |
| SCHEMBL7019031 | 0.72 | CYP1A2 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1357114-A1 | Substituted pyrimidin-2,4(1H,3H)-diones as inhibitors of Matrix Metalloproteinases (MMP) | IBFB GmbH Privates Institut für biomedizinische Forschung und Beratung (DE) | 2003-10-29 | — | — | EP | disclosed |