⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4649087 | 0.39 | — | — | |
| Water SCHEMBL20292 | 0.36 | — | — | |
| Water SCHEMBL490048 | 0.36 | — | — | |
| SCHEMBL23149820 | 0.35 | — | — | |
| SCHEMBL23149826 | 0.32 | — | — | |
| Water SCHEMBL15019930 | 0.30 | — | — | |
| SCHEMBL11602107 | 0.30 | — | — | |
| Water SCHEMBL20970284 | 0.30 | — | — | |
| SCHEMBL29663 | 0.30 | — | — | |
| Water SCHEMBL1662669 | 0.30 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2993169-A1 | ARYL-PYRIDINE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS | Novartis AG (CH) | 2016-03-09 | — | — | EP | disclosed |
| EP-2501678-B1 | ARYL-PYRIDINE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS | NOVARTIS AG (CH) | 2015-09-23 | — | — | EP | disclosed |