⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7621662 | 0.65 | — | — | |
| SCHEMBL11120860 | 0.64 | — | — | |
| SCHEMBL7248708 | 0.56 | — | — | |
| SCHEMBL18552486 | 0.56 | TSHR (0.33) | — | |
| SCHEMBL18821565 | 0.55 | — | — | |
| SCHEMBL24176108 | 0.52 | — | — | |
| SCHEMBL4139448 | 0.52 | — | — | |
| SCHEMBL20504145 | 0.49 | TSHR (0.35) | — | |
| SCHEMBL18650250 | 0.49 | — | — | |
| SCHEMBL11112738 | 0.48 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0429751-B1 | SUBSTITUTED 3-AMINO-SYDNONIMINES, PROCESS FOR THEIR PREPARATION AND THEIR USE | CASSELLA Aktiengesellschaft (DE) | 1993-06-16 | — | — | EP | disclosed |
| US-5120732-A | Treating cardiovascular disorders | CASSELLA AKTIENGESELLSCHAFT (DE) | 1992-06-09 | — | — | US | disclosed |
| EP-0457199-A1 | Substituted 3-Aminosydnonimines, method for their preparation and their use | CASSELLA Aktiengesellschaft (DE) | 1991-11-21 | — | — | EP | disclosed |
| EP-0429751-A2 | Substituted 3-amino-sydnonimines, process for their preparation and their use | CASSELLA Aktiengesellschaft (DE) | 1991-06-05 | — | — | EP | disclosed |