⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11101727 | 1.00 | — | — | |
| SCHEMBL11401026 | 1.00 | — | — | |
| SCHEMBL10961343 | 1.00 | — | — | |
| SCHEMBL11081873 | 1.00 | — | — | |
| SCHEMBL11200020 | 0.97 | — | — | |
| SCHEMBL11086255 | 0.92 | — | — | |
| SCHEMBL11391183 | 0.89 | — | — | |
| SCHEMBL11104360 | 0.89 | — | — | |
| SCHEMBL11198394 | 0.79 | ABCB1 (0.30) | — | |
| SCHEMBL11274860 | 0.79 | ABCB1 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0032432-B1 | PROSTANOID COMPOUNDS AND THEIR PREPARATION AND PHARMACEUTICAL FORMULATIONS | GLAXO GROUP LIMITED (GB) | 1985-07-24 | — | — | EP | disclosed |