⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL509556 | 0.95 | — | — | |
| SCHEMBL2502909 | 0.95 | — | — | |
| SCHEMBL2502906 | 0.95 | — | — | |
| SCHEMBL510049 | 0.94 | — | — | |
| SCHEMBL10211782 | 0.94 | — | — | |
| SCHEMBL3120911 | 0.94 | — | — | |
| SCHEMBL3113827 | 0.94 | — | — | |
| SCHEMBL3110253 | 0.93 | — | — | |
| SCHEMBL10212647 | 0.92 | — | — | |
| SCHEMBL3112577 | 0.92 | — | — |
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-8071605-B2 | Piperidine compounds for use in the treatment of bacterial infections | ASTRAZENECA AB (SE) | 2011-12-06 | — | — | US | disclosed |
| US-20100173909-A1 | PIPERIDINE COMPOUNDS AND USES THEREOF - 596 | ASTRAZENECA AB (SE) | 2010-07-08 | — | — | US | disclosed |