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 | |
|---|---|---|---|---|
| SCHEMBL17017384 | 1.00 | HCRTR1 (0.76) | HCRTR1HCRTR2 | |
| SCHEMBL17017370 | 0.89 | HCRTR1 (0.79) | HCRTR1HCRTR2 | |
| SCHEMBL17166365 | 0.89 | HCRTR1 (0.79) | HCRTR1HCRTR2 | |
| SCHEMBL17017362 | 0.88 | HCRTR1 (0.84) | HCRTR1HCRTR2 | |
| SCHEMBL17028091 | 0.87 | HCRTR1 (1.00) | HCRTR1HCRTR2 | |
| SCHEMBL17021494 | 0.87 | HCRTR1 (1.00) | HCRTR1HCRTR2 | |
| SCHEMBL17007229 | 0.87 | HCRTR1 (1.00) | HCRTR1HCRTR2 | |
| SCHEMBL17017459 | 0.86 | HCRTR1 (0.80) | HCRTR1HCRTR2 | |
| SCHEMBL17017377 | 0.85 | HCRTR1 (0.78) | HCRTR1HCRTR2 | |
| SCHEMBL17166369 | 0.85 | HCRTR1 (0.78) | 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 |
|---|---|---|---|---|---|---|---|
| US-9156829-B2 | Cycloalkyl and heterocycloalkyl compounds as orexin receptor antagonists | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2015-10-13 | — | — | US | disclosed |