Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 8/20 | 0.54 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.49 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27506299 | 1.00 | GPR84 (0.54) | GPR84FFAR1FFAR4NFKB1ZDHHC7 | |
| SCHEMBL9457090 | 0.87 | GPR84 (0.54) | GPR84FFAR1FFAR4NFKB1ZDHHC7 | |
| SCHEMBL28769950 | 0.87 | GPR84 (0.54) | GPR84FFAR1FFAR4NFKB1ZDHHC7 | |
| SCHEMBL11967098 | 0.84 | GPR84 (0.51) | GPR84FFAR1FFAR4NFKB1ZDHHC7 | |
| SCHEMBL5448275 | 0.83 | ZDHHC7 (0.44) | GPR84FFAR1ZDHHC7MEN1KMT2A | |
| SCHEMBL15153453 | 0.83 | FFAR1 (0.50) | GPR84FFAR1FFAR4NFKB1MEN1 | |
| SCHEMBL2817552 | 0.83 | GPR84 (0.67) | GPR84FFAR1FFAR4FAAH | |
| SCHEMBL4988168 | 0.83 | ZDHHC7 (0.44) | GPR84FFAR1ZDHHC7MEN1KMT2A | |
| SCHEMBL6828633 | 0.82 | TDP1 (0.50) | GPR84FFAR1ZDHHC7MEN1KMT2A | |
| SCHEMBL182928 | 0.82 | TDP1 (0.50) | GPR84FFAR1ZDHHC7MEN1KMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1193992-C | Synthesis of 3,6-dialkyl 5,6-dihydro-4-hydroxide-2H-pyran-2-ketone | HOFFMANN LA ROCHE (CH) | 2005-03-23 | — | — | CN | disclosed |
| EP-1127886-B1 | Synthesis of 3,6-dialkyl-5,6-dihydro-4-hydroxy-2H-pyran-2one | HOFFMANN LA ROCHE (CH) | 2003-05-07 | — | — | EP | disclosed |
| US-6552204-B1 | Lactonization of an acyl halide and a ketene acetal or reacting acyl halide with malonate half acid then cyclizing; high yield | ROCHE COLORADO CORPORATION | 2003-04-22 | — | — | US | disclosed |
| CN-1319596-A | Synthesis of 3,6-dialkyl 5,6-dihydro-4-hydroxide-2H-pyran-2-ketone | HOFFMANN LA ROCHE (CH) | 2001-10-31 | — | — | CN | disclosed |
| EP-1127886-A1 | Synthesis of 3,6-dialkyl-5,6-dihydro-4-hydroxy-2H-pyran-2one | F. HOFFMANN-LA ROCHE AG (CH) | 2001-08-29 | — | — | EP | disclosed |