⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6637298 | 0.90 | ESR1 (0.32) | — | |
| SCHEMBL6637168 | 0.89 | KCNN4 (0.30) | — | |
| SCHEMBL6634536 | 0.83 | ESR1 (0.33) | — | |
| SCHEMBL6637846 | 0.82 | — | — | |
| SCHEMBL6638676 | 0.81 | SCN5A (0.34) | — | |
| SCHEMBL6634342 | 0.81 | — | — | |
| SCHEMBL6634824 | 0.81 | TAAR1 (0.31) | — | |
| SCHEMBL6640070 | 0.80 | SCN5A (0.36) | — | |
| SCHEMBL5469797 | 0.77 | CNR2 (0.33) | — | |
| SCHEMBL7140655 | 0.77 | TAAR1 (0.36) | — |
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-1165557-B1 | ARYL AND HETEROARYL FUSED AMINOALKYL-IMIDAZOLE DERIVATIVES: SELECTIVE MODULATORS OF GABAa RECEPTORS | NEUROGEN CORP (US) | 2004-09-29 | — | — | EP | claimed |