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 | |
|---|---|---|---|---|
| SCHEMBL8676611 | 0.83 | TSHR (0.33) | — | |
| Bicarbonate SCHEMBL8466907 | 0.74 | — | — | |
| SCHEMBL9504373 | 0.70 | SLC22A6 (0.38) | ALDH1A1SLC22A6 | |
| SCHEMBL8678309 | 0.69 | — | — | |
| SCHEMBL1132009 | 0.68 | SLC22A6 (0.39) | SLC22A6 | |
| SCHEMBL10866600 | 0.65 | SLC22A6 (0.41) | ALDH1A1SLC22A6 | |
| SCHEMBL6460798 | 0.64 | — | — | |
| SCHEMBL7521295 | 0.64 | — | — | |
| SCHEMBL158448 | 0.64 | — | — | |
| SCHEMBL8466932 | 0.63 | ALDH1A1 (0.30) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0780362-B1 | 3,3-Dioxy-4,4,4-trifluorobutyric acid derivatives | BAYER AG (DE) | 1999-10-20 | — | — | EP | disclosed |
| US-5739394-A | 3,3-dioxy-4,4,4-trifluorobutyric acid derivatives | BAYER AKTIENGESELLSCHAFT (DE) | 1998-04-14 | — | — | US | disclosed |
| EP-0780362-A1 | 3,3-Dioxy-4,4,4-trifluorobutyric acid derivatives | BAYER AG (DE) | 1997-06-25 | — | — | EP | disclosed |