⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7274599 | 0.79 | CTSD (0.33) | — | |
| SCHEMBL7274603 | 0.79 | CTSD (0.33) | — | |
| SCHEMBL9615179 | 0.79 | CTSD (0.37) | — | |
| SCHEMBL7266627 | 0.77 | CTSD (0.33) | — | |
| SCHEMBL7266630 | 0.77 | CTSD (0.33) | — | |
| SCHEMBL7280255 | 0.75 | CTSD (0.33) | — | |
| SCHEMBL7283590 | 0.75 | CTSD (0.33) | — | |
| SCHEMBL7267629 | 0.74 | HPGD (0.39) | — | |
| SCHEMBL7267634 | 0.74 | HPGD (0.39) | — | |
| SCHEMBL9417461 | 0.67 | KDM6B (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5459131-A | Renin inhibitors | AMERICAN CYANAMID COMPANY (US) | 1995-10-17 | — | — | US | disclosed |
| US-5189023-A | Hypotensive agent | AMERICAN CYANAMID COMPANY (US) | 1993-02-23 | — | — | US | disclosed |