⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL419917 | 0.91 | CCR2 (0.31) | — | |
| SCHEMBL30915787 | 0.86 | — | — | |
| SCHEMBL30196745 | 0.86 | — | — | |
| SCHEMBL9095092 | 0.86 | — | — | |
| SCHEMBL16246596 | 0.84 | CCR2 (0.36) | — | |
| SCHEMBL27467506 | 0.84 | NISCH (0.34) | — | |
| SCHEMBL22510032 | 0.83 | CCR2 (0.39) | — | |
| SCHEMBL37603 | 0.82 | — | — | |
| SCHEMBL918438 | 0.82 | NISCH (0.38) | — | |
| SCHEMBL27451622 | 0.82 | NISCH (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7135484-B2 | Azabicyclic compounds are central nervous system active agents | ABBOTT LABORATORIES (US) | 2006-11-14 | — | — | US | disclosed |
| US-20040044029-A1 | Azabicyclic compounds are central nervous system active agents | ABBOTT LABORATORIES | 2004-03-04 | — | — | US | disclosed |