⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL867557 | 0.75 | — | — | |
| SCHEMBL7914298 | 0.75 | — | — | |
| SCHEMBL17853476 | 0.74 | — | — | |
| SCHEMBL3069939 | 0.67 | — | — | |
| SCHEMBL3069937 | 0.67 | — | — | |
| SCHEMBL22415201 | 0.67 | — | — | |
| SCHEMBL14072793 | 0.67 | — | — | |
| SCHEMBL18559956 | 0.65 | — | — | |
| SCHEMBL20904540 | 0.65 | — | — | |
| SCHEMBL22295552 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020016235-A1 | COMPOUNDS FOR USE IN THE TREATMENT OF FASCIOLIASIS | MERCK PATENT GMBH (DE) | 2020-01-23 | — | — | WO | disclosed |
| WO-2018130853-A1 | COMPOUNDS AND THEIR USE IN THE TREATMENT OF SCHISTOSOMIASIS | SALVENSIS (GB) | 2018-07-19 | — | — | WO | disclosed |