⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11640347 | 0.91 | CNR2 (0.42) | — | |
| SCHEMBL11637204 | 0.87 | — | — | |
| SCHEMBL11638949 | 0.83 | CNR2 (0.34) | — | |
| SCHEMBL11636847 | 0.83 | CNR2 (0.44) | — | |
| SCHEMBL11333242 | 0.77 | CNR2 (0.43) | — | |
| SCHEMBL11796295 | 0.76 | CNR2 (0.33) | — | |
| SCHEMBL11640760 | 0.76 | CNR2 (0.42) | — | |
| SCHEMBL11328337 | 0.76 | CNR2 (0.42) | — | |
| SCHEMBL11712333 | 0.76 | CNR2 (0.55) | — | |
| SCHEMBL11336664 | 0.75 | CNR2 (0.42) | — |
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-4096265-A | HYPOTENSIVE AGENTS | SHARPS ASSOCIATES (US) | 1978-06-20 | — | — | US | claimed |
| US-4096265-A | HYPOTENSIVE AGENTS | SHARPS ASSOCIATES (US) | 1978-06-20 | — | — | US | disclosed |