Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.35 |
| ▸ | PPARD | Q03181 | 18/20 | 0.33 |
| ▸ | PPARA | Q07869 | 18/20 | 0.33 |
| ▸ | PPARG | P37231 | 12/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL479942 | 0.90 | FBP1 (0.38) | PTGDR2PPARA | |
| SCHEMBL480100 | 0.83 | PTGER4 (0.35) | — | |
| SCHEMBL479197 | 0.81 | SCN8A (0.34) | PPARDPPARAPPARG | |
| SCHEMBL479998 | 0.79 | ALDH1A1 (0.34) | — | |
| SCHEMBL479879 | 0.79 | ACACB (0.32) | — | |
| SCHEMBL733521 | 0.78 | PPARD (0.34) | PTGDR2PPARDPPARAPPARG | |
| SCHEMBL753132 | 0.78 | PPARD (0.34) | PTGDR2PPARDPPARAPPARG | |
| SCHEMBL479923 | 0.77 | SCN8A (0.36) | PPARDPPARAPPARG | |
| SCHEMBL480094 | 0.76 | ACACB (0.32) | — | |
| SCHEMBL479715 | 0.74 | IGFBP3 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2411361-A1 | 1,1,1-TRIFLUORO-2-HYDROXYPROPYL COMPOUNDS | F. Hoffmann-La Roche AG (CH) | 2012-02-01 | — | — | EP | claimed |
| WO-2010108902-A1 | 1,1,1-TRIFLUORO-2-HYDROXYPROPYL COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-09-30 | — | — | WO | claimed |
| EP-2411361-A1 | 1,1,1-TRIFLUORO-2-HYDROXYPROPYL COMPOUNDS | F. Hoffmann-La Roche AG (CH) | 2012-02-01 | — | — | EP | disclosed |
| WO-2010108902-A1 | 1,1,1-TRIFLUORO-2-HYDROXYPROPYL COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-09-30 | — | — | WO | disclosed |