⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL242974 | 0.82 | GPR4 (0.50) | — | |
| SCHEMBL8701472 | 0.80 | — | — | |
| SCHEMBL2884118 | 0.80 | — | — | |
| SCHEMBL8706550 | 0.77 | — | — | |
| SCHEMBL7418463 | 0.74 | — | — | |
| SCHEMBL8701495 | 0.74 | GPR4 (0.44) | — | |
| SCHEMBL8999041 | 0.73 | — | — | |
| SCHEMBL7422043 | 0.73 | AGTR1 (0.40) | — | |
| SCHEMBL8701715 | 0.72 | AGTR1 (0.36) | — | |
| SCHEMBL8705362 | 0.72 | GPR4 (0.43) | — |
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-5789415-A | Azacyclic-heterocyclic compounds as angiotension II receptor antagonists | PFIZER INC. (US) | 1998-08-04 | — | — | US | disclosed |