⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17789681 | 0.90 | — | — | |
| SCHEMBL22626610 | 0.89 | — | — | |
| SCHEMBL17789679 | 0.89 | — | — | |
| SCHEMBL22626514 | 0.89 | — | — | |
| SCHEMBL17789678 | 0.88 | — | — | |
| SCHEMBL16377709 | 0.87 | USP30 (0.31) | — | |
| SCHEMBL16377707 | 0.85 | HTR2A (0.32) | — | |
| SCHEMBL17789692 | 0.85 | — | — | |
| SCHEMBL17783225 | 0.84 | CCNA2 (0.37) | — | |
| SCHEMBL29670825 | 0.84 | CCNA2 (0.37) | — |
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-B1 | PYRAZOLE COMPOUNDS AS MODULATORS OF FSHR AND USES THEREOF | MERCK PATENT GMBH (DE) | 2020-11-04 | — | — | EP | disclosed |
| US-20160152626-A1 | PYRAZOLE COMPOUNDS AS MODULATORS OF FSHR AND USES THEREOF | MERCK PATENT GMBH (DE) | 2016-06-02 | — | — | US | disclosed |