⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9402492 | 0.94 | — | — | |
| SCHEMBL9402180 | 0.90 | — | — | |
| SCHEMBL9402209 | 0.90 | — | — | |
| SCHEMBL9402170 | 0.89 | — | — | |
| SCHEMBL9402195 | 0.88 | AGTR1 (0.60) | — | |
| SCHEMBL9402273 | 0.88 | — | — | |
| SCHEMBL9402352 | 0.87 | — | — | |
| SCHEMBL9402275 | 0.87 | — | — | |
| SCHEMBL9402475 | 0.87 | — | — | |
| SCHEMBL9402334 | 0.86 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5336778-A | Substituted triazoles as angiotensin II antagonists | MERCK & CO., INC. (US) | 1994-08-09 | — | — | US | disclosed |