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 | |
|---|---|---|---|---|
| SCHEMBL3526061 | 0.94 | KCNH2 (0.85) | KCNH2CCR5 | |
| SCHEMBL3530722 | 0.93 | KCNH2 (1.00) | KCNH2CCR5 | |
| SCHEMBL13543882 | 0.93 | KCNH2 (1.00) | KCNH2CCR5 | |
| SCHEMBL13543112 | 0.93 | CCR5 (0.86) | KCNH2CCR5 | |
| SCHEMBL13543829 | 0.92 | KCNH2 (0.83) | KCNH2CCR5 | |
| SCHEMBL3529449 | 0.92 | KCNH2 (0.83) | KCNH2CCR5 | |
| SCHEMBL13544261 | 0.92 | KCNH2 (1.00) | KCNH2CCR5 | |
| SCHEMBL3526647 | 0.92 | KCNH2 (1.00) | KCNH2CCR5 | |
| SCHEMBL3526001 | 0.91 | KCNH2 (0.84) | KCNH2CCR5 | |
| SCHEMBL3526013 | 0.90 | KCNH2 (0.89) | KCNH2CCR5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1569646-A2 | PIPERIDINE DERIVATIVES AS CCR5 ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 2005-09-07 | — | — | EP | disclosed |
| WO-2004054974-A2 | PIPERIDINE DERIVATIVES AS CCR5 ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 2004-07-01 | — | — | WO | disclosed |