⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5848037 | 0.75 | — | — | |
| SCHEMBL6643593 | 0.66 | — | — | |
| SCHEMBL8939186 | 0.65 | — | — | |
| SCHEMBL1655428 | 0.64 | — | — | |
| SCHEMBL668518 | 0.63 | BACE1 (0.39) | — | |
| SCHEMBL30021759 | 0.62 | BACE1 (0.38) | — | |
| SCHEMBL8517242 | 0.61 | — | — | |
| SCHEMBL5704894 | 0.61 | KDM4A (0.37) | — | |
| SCHEMBL13386056 | 0.61 | NISCH (0.37) | — | |
| SCHEMBL5138828 | 0.61 | BRD4 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008146064-A1 | NEW BENZOFURAN DERIVATIVES AS SELECTIVE 5HT7 RECEPTOR INHIBITORS AND PROCESS FOR THEIR PREPARATION | EGIS GYÓGYSZERGYÁR (HU) | 2008-12-04 | — | — | WO | disclosed |