⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9418782 | 0.81 | — | — | |
| SCHEMBL312746 | 0.81 | — | — | |
| SCHEMBL9514119 | 0.79 | — | — | |
| SCHEMBL22228978 | 0.79 | — | — | |
| SCHEMBL644043 | 0.79 | — | — | |
| SCHEMBL23743752 | 0.79 | — | — | |
| SCHEMBL9354654 | 0.79 | — | — | |
| SCHEMBL22556011 | 0.78 | TSHR (0.32) | — | |
| SCHEMBL4488255 | 0.77 | TSHR (0.43) | — | |
| SCHEMBL10687376 | 0.77 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118304295-A | Pharmaceutical composition of endothelin A (ETA) receptor antagonist compound and application thereof | 深圳信立泰药业股份有限公司 | 2024-07-09 | — | — | CN | disclosed |
| CN-117447453-A | Pharmaceutically acceptable salt crystal forms of endothelin A (ETA) receptor antagonist compounds and preparation method thereof | 深圳信立泰药业股份有限公司 | 2024-01-26 | — | — | CN | disclosed |
| CN-116194449-A | Endothelin A (ETA) receptor antagonist compound and preparation method and medical application thereof | 深圳信立泰药业股份有限公司 | 2023-05-30 | — | — | CN | disclosed |
| EP-0392358-B1 | Marine blue and black dyestuff mixtures | BASF AG (DE) | 1993-12-01 | — | — | EP | disclosed |
| EP-0392358-A1 | Marine blue and black dyestuff mixtures | BASF Aktiengesellschaft (DE) | 1990-10-17 | — | — | EP | disclosed |