⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22626562 | 0.70 | — | — | |
| SCHEMBL22626244 | 0.69 | NR1H4 (0.31) | — | |
| SCHEMBL22626510 | 0.69 | — | — | |
| SCHEMBL22626410 | 0.69 | NR1H4 (0.31) | — | |
| SCHEMBL22626596 | 0.68 | — | — | |
| SCHEMBL22626388 | 0.66 | TP53 (0.32) | — | |
| SCHEMBL22626523 | 0.65 | NR1H4 (0.34) | — | |
| SCHEMBL24519318 | 0.64 | NR1H4 (0.30) | — | |
| SCHEMBL16377728 | 0.64 | NR1H4 (0.33) | — | |
| SCHEMBL24519303 | 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 1 patent. 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 |