Predicted protein targets (top 2)
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL12727256 | 0.90 | GNRHR (0.91) | GNRHRCYP3A4 | |
| SCHEMBL22487833 | 0.90 | GNRHR (0.83) | GNRHRCYP3A4 | |
| SCHEMBL172253 | 0.88 | GNRHR (0.91) | GNRHRCYP3A4 | |
| SCHEMBL25771268 | 0.87 | GNRHR (0.82) | GNRHRCYP3A4 | |
| SCHEMBL24827496 | 0.87 | GNRHR (0.76) | GNRHRCYP3A4 | |
| SCHEMBL5758037 | 0.85 | GNRHR (1.00) | GNRHRCYP3A4 | |
| SCHEMBL5758034 | 0.85 | GNRHR (1.00) | GNRHRCYP3A4 | |
| SCHEMBL30299007 | 0.85 | GNRHR (1.00) | GNRHRCYP3A4 | |
| SCHEMBL5758028 | 0.85 | GNRHR (1.00) | GNRHRCYP3A4 | |
| SCHEMBL25445015 | 0.85 | GNRHR (0.84) | GNRHRCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021130776-A1 | AN IMPROVED PROCESS FOR THE PREPARATION OF 4-({(1 R)-2-[5-(2-FLUORO-3METHOXYPHENYL)-3-{[2-FLUORO-6-(TRIFLUORO METHYL) PHENYL]METHYL}-4-METHYL-2,6-DIOXO-3,6DIHYDROPYRIMIDIN-1(2 H)-YL]-1-PHENYLETHYL}AMINO)BUTANOIC ACID OR ITS PHARMACEUTICALLY ACCEPTABLE SALTS | MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) | 2021-07-01 | — | — | WO | disclosed |