⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9490000 | 0.89 | — | — | |
| SCHEMBL6968826 | 0.81 | — | — | |
| SCHEMBL9490957 | 0.77 | — | — | |
| SCHEMBL7054490 | 0.77 | — | — | |
| SCHEMBL8536231 | 0.77 | — | — | |
| SCHEMBL6961075 | 0.76 | — | — | |
| SCHEMBL7055318 | 0.76 | — | — | |
| SCHEMBL8954214 | 0.76 | — | — | |
| SCHEMBL9474680 | 0.75 | — | — | |
| SCHEMBL683468 | 0.75 | AGTR1 (0.75) | — |
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-5177096-A | Angiotensin II receptor antagonist | SMITHKLINE BEECHAM CORPORATION (US) | 1993-01-05 | — | — | US | disclosed |