Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9196363 | 0.77 | ALDH1A1 (0.33) | CYP1A2ALDH1A1ALOX15TSHR | |
| SCHEMBL9189869 | 0.70 | ALDH1A1 (0.37) | CYP1A2ALDH1A1ALOX15TSHR | |
| SCHEMBL7804064 | 0.70 | ALDH1A1 (0.44) | CYP1A2ALDH1A1ALOX15TSHR | |
| SCHEMBL9432184 | 0.67 | CYP1A2 (0.61) | CYP1A2ALDH1A1ALOX15TSHR | |
| SCHEMBL9188793 | 0.67 | ALDH1A1 (0.33) | ALDH1A1ALOX15TSHR | |
| SCHEMBL9192993 | 0.65 | AURKA (0.32) | — | |
| SCHEMBL9188446 | 0.62 | — | — | |
| SCHEMBL7804920 | 0.62 | MEN1 (0.31) | ALDH1A1TSHR | |
| SCHEMBL7108425 | 0.61 | CYP1A2 (0.48) | CYP1A2 | |
| SCHEMBL9185625 | 0.57 | — | — |
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-0445644-B1 | Trifluoro- respectively chlorodifluoromethoxy pyrimidines and process for their preparation | BASF AG (DE) | 1995-05-24 | — | — | EP | disclosed |
| US-5237063-A | TRIFLUORO- AND CHLORODIFLUOROMETHOXYPYRIMIDINES AND THE PREPARATION THEREOF | BASF AKTIENGESELLSCHAFT (DE) | 1993-08-17 | — | — | US | disclosed |
| EP-0445644-A1 | Trifluoro- respectively chlorodifluoromethoxy pyrimidines and process for their preparation | BASF Aktiengesellschaft (DE) | 1991-09-11 | — | — | EP | disclosed |