Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 20/20 | 0.59 |
| ▸ | CCR5 | P51681 | 3/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 6/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3946507 | 1.00 | CCR2 (0.59) | CCR2CCR5KCNH2 | |
| SCHEMBL2784969 | 1.00 | CCR2 (0.59) | CCR2CCR5KCNH2 | |
| SCHEMBL2784973 | 1.00 | CCR2 (0.59) | CCR2CCR5KCNH2 | |
| SCHEMBL2785217 | 1.00 | CCR2 (0.59) | CCR2CCR5KCNH2 | |
| SCHEMBL3256079 | 0.89 | CCR2 (0.54) | CCR2CCR5KCNH2 | |
| SCHEMBL3256072 | 0.89 | CCR2 (0.54) | CCR2CCR5KCNH2 | |
| SCHEMBL3250364 | 0.88 | CCR2 (0.55) | CCR2CCR5KCNH2 | |
| SCHEMBL3250362 | 0.88 | CCR2 (0.55) | CCR2CCR5KCNH2 | |
| SCHEMBL3746858 | 0.87 | CCR2 (0.66) | CCR2CCR5KCNH2 | |
| SCHEMBL3746851 | 0.87 | CCR2 (0.66) | CCR2CCR5KCNH2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2049519-A2 | CYCLIC DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | Brystol-Myers Squibb Company (US) | 2009-04-22 | — | — | EP | disclosed |
| EP-2049477-A2 | MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY, CRYSTALLINE FORMS AND PROCESS | Brystol-Myers Squibb Company (US) | 2009-04-22 | — | — | EP | disclosed |
| WO-2008014381-A2 | MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY, CRYSTALLINE FORMS AND PROCESS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-01-31 | — | — | WO | disclosed |
| WO-2008014361-A2 | CYCLIC DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-01-31 | — | — | WO | disclosed |