⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23112977 | 0.76 | — | — | |
| SCHEMBL19331146 | 0.71 | CCR8 (0.31) | — | |
| SCHEMBL23329163 | 0.70 | IKBKB (0.31) | — | |
| SCHEMBL27362947 | 0.69 | NPSR1 (0.34) | — | |
| SCHEMBL4781868 | 0.68 | NOTUM (0.33) | — | |
| SCHEMBL918324 | 0.68 | DCUN1D1 (0.47) | — | |
| SCHEMBL184092 | 0.67 | DCUN1D1 (0.44) | — | |
| SCHEMBL14440820 | 0.67 | POLB (0.34) | — | |
| SCHEMBL2028396 | 0.66 | ADH5 (0.32) | — | |
| SCHEMBL4784479 | 0.65 | NQO1 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008031888-A2 | CONDENSED PYRIMIDINONES ACTIVE ON GLUTAMATERGIC RECEPTORS | CAMPIANI GIUSEPPE (IT) | 2008-03-20 | — | — | WO | claimed |
| WO-2008031888-A2 | CONDENSED PYRIMIDINONES ACTIVE ON GLUTAMATERGIC RECEPTORS | CAMPIANI GIUSEPPE (IT) | 2008-03-20 | — | — | WO | disclosed |