⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4255054 | 0.92 | L3MBTL1 (0.33) | — | |
| SCHEMBL5013687 | 0.90 | L3MBTL1 (0.31) | — | |
| SCHEMBL4265633 | 0.80 | L3MBTL1 (0.33) | — | |
| SCHEMBL4256168 | 0.78 | NSD2 (0.33) | — | |
| SCHEMBL4262651 | 0.74 | TACR2 (0.43) | — | |
| SCHEMBL4412709 | 0.74 | — | — | |
| SCHEMBL4261247 | 0.74 | NSD2 (0.33) | — | |
| Hydrochloric Acid SCHEMBL5013689 | 0.74 | TACR2 (0.43) | — | |
| SCHEMBL5070660 | 0.72 | CXCR5 (0.32) | — | |
| SCHEMBL4263016 | 0.68 | L3MBTL1 (0.45) | — |
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-7402581-B2 | Azetidine compounds | ALBIREO AB (SE) | 2008-07-22 | — | — | US | disclosed |
| US-20060172988-A1 | Azetidine compounds | ALBIREO AB (SE) | 2006-08-03 | — | — | US | disclosed |