⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9732644 | 0.79 | — | — | |
| SCHEMBL9732647 | 0.79 | — | — | |
| SCHEMBL133762 | 0.72 | — | — | |
| SCHEMBL6255517 | 0.68 | — | — | |
| SCHEMBL3452328 | 0.68 | — | — | |
| SCHEMBL11236061 | 0.68 | — | — | |
| SCHEMBL6255516 | 0.68 | — | — | |
| SCHEMBL31392373 | 0.66 | POLB (0.50) | — | |
| SCHEMBL604518 | 0.66 | POLB (0.50) | — | |
| SCHEMBL2145668 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3013832-A1 | PYRAZOLE COMPOUNDS AS MODULATORS OF FSHR AND USES THEREOF | Merck Patent GmbH (DE) | 2016-05-04 | — | — | EP | disclosed |
| WO-2014209980-A1 | PYRAZOLE COMPOUNDS AS MODULATORS OF FSHR AND USES THEREOF | MERCK PATENT GMBH (DE) | 2014-12-31 | — | — | WO | disclosed |