Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 19/20 | 0.53 |
| ▸ | CCR1 | P32246 | 1/20 | 0.53 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.53 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL16573788 | 0.90 | CCR2 (0.51) | CCR2CCR1TMEM97SIGMAR1KCNH2 | |
| SCHEMBL13226272 | 0.88 | CCR2 (0.67) | CCR2CCR1TMEM97SIGMAR1KCNH2 | |
| SCHEMBL13226257 | 0.87 | CCR2 (0.62) | CCR2CCR1TMEM97SIGMAR1KCNH2 | |
| SCHEMBL14599252 | 0.87 | CCR2 (0.53) | CCR2 | |
| SCHEMBL16573787 | 0.87 | CCR2 (0.49) | CCR2CCR1TMEM97SIGMAR1KCNH2 | |
| SCHEMBL18699975 | 0.86 | CCR2 (0.47) | CCR2CCR1TMEM97SIGMAR1KCNH2 | |
| SCHEMBL16577010 | 0.86 | CCR2 (0.48) | CCR2CCR1TMEM97SIGMAR1KCNH2 | |
| SCHEMBL13226456 | 0.85 | CCR2 (0.59) | CCR2CCR1TMEM97SIGMAR1KCNH2 | |
| SCHEMBL13226449 | 0.85 | CCR2 (0.60) | CCR2CCR1TMEM97SIGMAR1KCNH2 | |
| SCHEMBL13226464 | 0.84 | CCR2 (0.57) | CCR2CCR1TMEM97SIGMAR1KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7786305-B2 | Tetrahydropyranyl cyclopentyl tetrahydropyridopyridine modulators of chemokine receptor activity | MERCK SHARP & DOHME CORP. (US) | 2010-08-31 | — | — | US | disclosed |
| US-7786305-B2 | Tetrahydropyranyl cyclopentyl tetrahydropyridopyridine modulators of chemokine receptor activity | MERCK SHARP & DOHME CORP. (US) | 2010-08-31 | — | — | US | disclosed |
| US-7230008-B2 | Tetrahydropyranyl cyclopentyl tetrahydropyridopyridine modulators of chemokine receptor activity | MERCK & CO, INC. (US) | 2007-06-12 | — | — | US | disclosed |
| US-7230008-B2 | Tetrahydropyranyl cyclopentyl tetrahydropyridopyridine modulators of chemokine receptor activity | MERCK & CO, INC. (US) | 2007-06-12 | — | — | US | disclosed |