Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 8/20 | 0.37 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.32 |
| ▸ | CCR1 | P32246 | 1/20 | 0.32 |
| ▸ | CCR5 | P51681 | 1/20 | 0.32 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5699571 | 0.87 | CCR2 (0.33) | CCR2CCR1CCR5CXCR4 | |
| SCHEMBL5699574 | 0.87 | CCR2 (0.33) | CCR2CCR1CCR5CXCR4 | |
| SCHEMBL1114567 | 0.87 | CCR2 (0.33) | CCR2CCR1CCR5CXCR4 | |
| SCHEMBL1114805 | 0.87 | CCR2 (0.33) | CCR2CCR1CCR5CXCR4 | |
| SCHEMBL10476331 | 0.80 | CCR2 (0.44) | CCR2NOD1CCR1CCR5CXCR4 | |
| SCHEMBL1114657 | 0.77 | CCR2 (0.52) | CCR2NOD1CCR1CCR5CXCR4 | |
| SCHEMBL1114788 | 0.77 | CCR2 (0.52) | CCR2NOD1CCR1CCR5CXCR4 | |
| SCHEMBL5699622 | 0.77 | CCR2 (0.52) | CCR2NOD1CCR1CCR5CXCR4 | |
| SCHEMBL5699632 | 0.77 | CCR2 (0.52) | CCR2NOD1CCR1CCR5CXCR4 | |
| SCHEMBL1114631 | 0.72 | CCR2 (0.47) | CCR2NOD1 |
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-2279741-A2 | Caprolactams and their use as anti-inflammatory agents | Cambridge Enterprise Ltd. (GB) | 2011-02-02 | — | — | EP | claimed |