⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22626378 | 0.96 | — | — | |
| SCHEMBL17789658 | 0.92 | ADRA2A (0.30) | — | |
| SCHEMBL16377695 | 0.91 | ADRA2A (0.31) | — | |
| SCHEMBL24519326 | 0.88 | — | — | |
| SCHEMBL22626517 | 0.87 | — | — | |
| SCHEMBL24519337 | 0.87 | PIK3CD (0.34) | — | |
| SCHEMBL16377777 | 0.83 | PIK3CD (0.33) | — | |
| SCHEMBL22626532 | 0.82 | — | — | |
| SCHEMBL20580158 | 0.82 | PIK3CD (0.37) | — | |
| SCHEMBL16377776 | 0.81 | PIK3CD (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-11365199-B2 | Pyrazole compounds as modulators of FSHR and uses thereof | MERCK PATENT GMBH (DE) | 2022-06-21 | — | — | US | disclosed |