Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 20/20 | 0.57 |
| ▸ | HCRTR2 | O43614 | 20/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1672008 | 0.95 | HCRTR1 (0.58) | HCRTR1HCRTR2CYP1A2KCNH2 | |
| SCHEMBL1673137 | 0.90 | HCRTR1 (0.57) | HCRTR1HCRTR2 | |
| SCHEMBL1671888 | 0.87 | HCRTR1 (0.58) | HCRTR1HCRTR2CYP1A2KCNH2 | |
| SCHEMBL1671733 | 0.87 | HCRTR1 (0.56) | HCRTR1HCRTR2 | |
| SCHEMBL1671097 | 0.87 | HCRTR1 (0.56) | HCRTR1HCRTR2 | |
| SCHEMBL1671655 | 0.86 | HCRTR1 (0.55) | HCRTR1HCRTR2 | |
| SCHEMBL1671116 | 0.86 | HCRTR1 (0.56) | HCRTR1HCRTR2CYP1A2KCNH2 | |
| SCHEMBL1671561 | 0.86 | HCRTR1 (0.53) | HCRTR1HCRTR2 | |
| SCHEMBL1671487 | 0.86 | HCRTR1 (0.58) | HCRTR1HCRTR2 | |
| SCHEMBL1673026 | 0.84 | HCRTR1 (0.51) | HCRTR1HCRTR2CYP1A2KCNH2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012145581-A1 | DISUBSTITUTED OCTAHY-DROPYRROLO [3,4-C] PYRROLES AS OREXIN RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2012-10-26 | — | — | WO | disclosed |
| EP-2491038-A1 | DISUBSTITUTED OCTAHY - DROPYRROLO [3,4-C]PYRROLES AS OREXIN RECEPTOR MODULATORS | Janssen Pharmaceutica N.V. (BE) | 2012-08-29 | — | — | EP | disclosed |
| WO-2011050198-A1 | DISUBSTITUTED OCTAHY - DROPYRROLO [3,4-C] PYRROLES AS OREXIN RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2011-04-28 | — | — | WO | disclosed |