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 | |
|---|---|---|---|---|
| SCHEMBL4680461 | 0.67 | ALDH1A1 (0.33) | — | |
| SCHEMBL2902738 | 0.66 | TRPV4 (0.31) | — | |
| SCHEMBL10069117 | 0.66 | ESR1 (0.59) | PARP1 | |
| SCHEMBL5973793 | 0.65 | RAB9A (0.46) | — | |
| SCHEMBL4471415 | 0.63 | — | — | |
| SCHEMBL2478096 | 0.63 | — | — | |
| SCHEMBL11131077 | 0.62 | ESR1 (0.54) | — | |
| SCHEMBL4655065 | 0.62 | HTT (0.45) | — | |
| SCHEMBL295035 | 0.61 | CYP1A2 (0.54) | — | |
| SCHEMBL27777753 | 0.61 | PARP1 (0.40) | PARP1 |
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-3057949-A1 | SECONDARY ALCOHOL QUINOLINYL MODULATORS OF RORyt | Janssen Pharmaceutica N.V. (BE) | 2016-08-24 | — | — | EP | disclosed |
| WO-2015057206-A1 | SECONDARY ALCOHOL QUINOLINYL MODULATORS OF RORyt | JANSSEN PHARMACEUTICA NV (BE) | 2015-04-23 | — | — | WO | disclosed |