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 | |
|---|---|---|---|---|
| SCHEMBL9954722 | 0.92 | HCRTR1 (0.54) | HCRTR1HCRTR2 | |
| SCHEMBL9956516 | 0.87 | SPR (0.51) | HCRTR1HCRTR2 | |
| SCHEMBL9957016 | 0.86 | HCRTR2 (0.65) | HCRTR1HCRTR2 | |
| SCHEMBL9954161 | 0.84 | SPR (0.51) | HCRTR1HCRTR2 | |
| SCHEMBL9954160 | 0.84 | SPR (0.51) | HCRTR1HCRTR2 | |
| Hydrochloric Acid SCHEMBL9956777 | 0.82 | HCRTR1 (0.50) | HCRTR1HCRTR2 | |
| SCHEMBL9955001 | 0.78 | HCRTR2 (0.71) | HCRTR1HCRTR2 | |
| SCHEMBL9957452 | 0.77 | HCRTR2 (0.49) | HCRTR1HCRTR2 | |
| Hydrochloric Acid SCHEMBL9955455 | 0.77 | HCRTR1 (0.47) | HCRTR1HCRTR2 | |
| Hydrochloric Acid SCHEMBL9960571 | 0.77 | HCRTR1 (0.47) | HCRTR1HCRTR2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012085852-A1 | 3,8-DIAZA-BICYCLO[4.2.0]OCT-8-YL AMIDES | ACTELION PHARMACEUTICALS LTD (CH) | 2012-06-28 | — | — | WO | disclosed |