⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2684607 | 0.85 | — | — | |
| SCHEMBL3905395 | 0.84 | PAX8 (0.36) | — | |
| SCHEMBL5281026 | 0.82 | TSHR (0.36) | — | |
| SCHEMBL2684975 | 0.82 | — | — | |
| SCHEMBL2684431 | 0.82 | TSHR (0.36) | — | |
| SCHEMBL3912312 | 0.81 | — | — | |
| SCHEMBL3912300 | 0.81 | KDM4E (0.30) | — | |
| SCHEMBL3914447 | 0.78 | ACACB (0.35) | — | |
| SCHEMBL3943583 | 0.78 | KDM4E (0.34) | — | |
| SCHEMBL2682844 | 0.78 | GAA (0.41) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090029981-A1 | SUBSTITUTED 4-PHENYLPIPERIDINES | NOVARTIS AG (CH) | 2009-01-29 | — | — | US | disclosed |
| EP-2018862-A1 | Substituted piperidines as therapeutic compounds | Speedel Experimenta AG (CH) | 2009-01-28 | — | — | EP | disclosed |
| EP-1973903-A1 | SUBSTITUTED 4-PHENYLPIPERIDINES | Speedel Experimenta AG (CH) | 2008-10-01 | — | — | EP | disclosed |
| WO-2007082907-A1 | SUBSTITUTED 4-PHENYLPIPERIDINES | SPEEDEL EXPERIMENTA AG (CH) | 2007-07-26 | — | — | WO | disclosed |