⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4331240 | 0.78 | — | — | |
| SCHEMBL8701472 | 0.77 | — | — | |
| SCHEMBL4328034 | 0.76 | — | — | |
| SCHEMBL4322073 | 0.75 | — | — | |
| SCHEMBL8700948 | 0.74 | — | — | |
| SCHEMBL5091101 | 0.74 | — | — | |
| SCHEMBL5426008 | 0.74 | — | — | |
| SCHEMBL6046467 | 0.74 | GPR4 (0.71) | — | |
| SCHEMBL9199255 | 0.73 | — | — | |
| SCHEMBL5424269 | 0.73 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1995002596-A1 | AZACYCLIC-HETEROCYCLIC COMPOUNDS AS ANGIOTENSIN II RECEPTOR ANTAGONISTS | PFIZER INC. (US) | 1995-01-26 | — | — | WO | disclosed |