Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR4 | P51679 | 20/20 | 0.73 |
| ▸ | CCR5 | P51681 | 1/20 | 0.54 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.54 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL12473986 | 0.92 | CCR4 (0.73) | CCR4 | |
| SCHEMBL30447 | 0.86 | CCR4 (0.74) | CCR4CCR5FFAR4SLCO1B1 | |
| SCHEMBL30643 | 0.85 | CCR4 (0.87) | CCR4CCR5FFAR4SLCO1B1 | |
| SCHEMBL250494 | 0.84 | CCR4 (1.00) | CCR4CCR5FFAR4SLCO1B1 | |
| SCHEMBL31267 | 0.84 | CCR4 (0.82) | CCR4CCR5FFAR4SLCO1B1 | |
| SCHEMBL356169 | 0.83 | CCR4 (0.77) | CCR4CCR5FFAR4SLCO1B1 | |
| Hydrochloric Acid SCHEMBL30522128 | 0.83 | CCR4 (0.98) | CCR4CCR5FFAR4SLCO1B1 | |
| Hydrochloric Acid SCHEMBL248629 | 0.83 | CCR4 (0.98) | CCR4CCR5FFAR4SLCO1B1 | |
| SCHEMBL19079 | 0.81 | CCR4 (0.68) | CCR4CCR5FFAR4SLCO1B1 | |
| SCHEMBL10234777 | 0.78 | CCR4 (0.90) | CCR4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012025473-A1 | CC.CHEMOKINE RECEPTOR 4 ANTAGONISTS | GLAXO GROUP LIMITED (GB) | 2012-03-01 | — | — | WO | disclosed |
| WO-2012025473-A1 | CC.CHEMOKINE RECEPTOR 4 ANTAGONISTS | GLAXO GROUP LIMITED (GB) | 2012-03-01 | — | — | WO | disclosed |