Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9857687 | 0.87 | PTGS2 (0.41) | PTGS2 | |
| SCHEMBL9857638 | 0.85 | HMGCR (0.42) | — | |
| SCHEMBL9857529 | 0.84 | — | — | |
| SCHEMBL9857916 | 0.80 | AKR1C2 (0.39) | PTGS2 | |
| SCHEMBL9857896 | 0.78 | PTGS2 (0.39) | PTGS2 | |
| SCHEMBL9857634 | 0.76 | DHODH (0.43) | — | |
| SCHEMBL5171324 | 0.71 | PTGS2 (0.44) | PTGS2 | |
| SCHEMBL5762155 | 0.71 | ACHE (0.48) | PTGS2 | |
| SCHEMBL9857622 | 0.70 | AKR1C2 (0.42) | PTGS2 | |
| SCHEMBL15177384 | 0.70 | CA1 (0.59) | PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5072023-A | Reacting lactone with ester anion to form cyclohexenone ester; oxidizing or dehydrogenating the intermediate | E. R. SQUIBB & SONS, INC. (US) | 1991-12-10 | — | — | US | disclosed |
| EP-0442495-A1 | Process for preparing highly substituted phenyls | E.R. SQUIBB & SONS, INC. (US) | 1991-08-21 | — | — | EP | disclosed |