⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28753036 | 0.83 | FAAH (0.32) | — | |
| SCHEMBL27590701 | 0.71 | NISCH (0.32) | — | |
| SCHEMBL27590523 | 0.68 | BCHE (0.30) | — | |
| SCHEMBL27590555 | 0.66 | MTNR1A (0.34) | — | |
| SCHEMBL27609039 | 0.63 | LMNA (0.32) | — | |
| SCHEMBL2149436 | 0.61 | PPARG (0.37) | — | |
| SCHEMBL27609197 | 0.60 | SLC2A1 (0.34) | — | |
| SCHEMBL28750903 | 0.60 | FABP3 (0.34) | — | |
| SCHEMBL26700015 | 0.56 | TDP1 (0.41) | — | |
| SCHEMBL27898737 | 0.56 | FABP3 (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1561212-A | Benzimidazolone Derivatives as Muscarinic Agents | ACADIA PHARM INC (US) | 2005-01-05 | — | — | CN | disclosed |