Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 12/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 12/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 10/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.32 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.32 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2322133 | 0.84 | ALDH1A1 (0.39) | PGR | |
| SCHEMBL2314405 | 0.81 | HTR2B (0.39) | HDAC1HDAC2HDAC3PGR | |
| SCHEMBL2317591 | 0.80 | CYP3A4 (0.43) | PGRESR1ESR2 | |
| SCHEMBL2321527 | 0.77 | IMPDH2 (0.31) | — | |
| SCHEMBL2316316 | 0.77 | AKR1B1 (0.36) | — | |
| SCHEMBL2316048 | 0.76 | ESR1 (0.42) | HDAC1HDAC2HDAC3PGRESR1 | |
| SCHEMBL2316040 | 0.76 | ESR1 (0.42) | HDAC1HDAC2HDAC3PGRESR1 | |
| SCHEMBL2316362 | 0.75 | HTR1A (0.34) | PGR | |
| SCHEMBL2314396 | 0.74 | MAPT (0.34) | PGR | |
| SCHEMBL2319041 | 0.74 | CYP3A4 (0.35) | PGR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1609786-B1 | 5-alkenone-3,3-dimethyl-benzoxepines derivatives useful for the preparation of antidiabetic pentadienoic acids | MERCK SANTE SAS (FR) | 2011-08-03 | — | — | EP | claimed |