⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL130260 | 1.00 | — | — | |
| SCHEMBL26977085 | 0.94 | ALDH1A1 (0.44) | — | |
| SCHEMBL29126886 | 0.89 | LMNA (0.48) | — | |
| SCHEMBL8604366 | 0.87 | TRPA1 (0.50) | — | |
| SCHEMBL26977194 | 0.86 | ALDH1A1 (0.43) | — | |
| SCHEMBL1052619 | 0.82 | LMNA (0.39) | — | |
| SCHEMBL13667174 | 0.82 | LMNA (0.39) | — | |
| SCHEMBL1657981 | 0.80 | LMNA (0.43) | — | |
| SCHEMBL14875499 | 0.79 | TSHR (0.41) | — | |
| SCHEMBL28762 | 0.79 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2420491-B1 | 3 , 5-SUBSTITUED PIPERIDINE COMPOUNDS AS RENIN INHIBITORS | NOVARTIS AG (CH) | 2013-07-03 | — | — | EP | disclosed |
| EP-2420491-A1 | 3 , 5-substitued piperidine compounds as renin inhibitors | Novartis AG (CH) | 2012-02-22 | — | — | EP | disclosed |
| WO-2007077005-A1 | 3 , 5-SUBSTITΓUED PIPERIDINE COMPOUNDS AS RENIN INHIBITORS | NOVARTIS AG (CH) | 2007-07-12 | — | — | WO | disclosed |