⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11236311 | 0.88 | CPN1 (0.47) | — | |
| SCHEMBL6654542 | 0.86 | CPN1 (0.41) | — | |
| SCHEMBL4420168 | 0.82 | — | — | |
| SCHEMBL1691633 | 0.82 | — | — | |
| SCHEMBL1517058 | 0.82 | — | — | |
| SCHEMBL2315574 | 0.79 | SLC6A1 (0.38) | — | |
| SCHEMBL17315807 | 0.78 | — | — | |
| SCHEMBL1994090 | 0.78 | — | — | |
| SCHEMBL17315805 | 0.78 | — | — | |
| SCHEMBL3931499 | 0.78 | — | — |
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-1255739-A1 | 3-AMINOQUINAZOLIN-2,4-DIONE ANTIBACTERIAL AGENTS | WARNER-LAMBERT COMPANY (US) | 2002-11-13 | — | — | EP | disclosed |
| WO-2001053273-A1 | 3-AMINOQUINAZOLIN-2,4-DIONE ANTIBACTERIAL AGENTS | WARNER-LAMBERT COMPANY (US) | 2001-07-26 | — | — | WO | disclosed |