Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | G6PD | P11413 | 1/20 | 0.43 |
| ▸ | SOAT1 | P35610 | 11/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | P4HB | P07237 | 1/20 | 0.36 |
| ▸ | S100A4 | P26447 | 1/20 | 0.36 |
| ▸ | GPR84 | Q9NQS5 | 6/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11542520 | 0.88 | SOAT1 (0.44) | G6PDSOAT1CYP2C9CYP2C19GPR84 | |
| SCHEMBL11540658 | 0.88 | SOAT1 (0.44) | G6PDSOAT1CYP2C9CYP2C19GPR84 | |
| SCHEMBL11540280 | 0.84 | SOAT1 (0.41) | G6PDSOAT1CYP2C9CYP2C19P4HB | |
| SCHEMBL11542462 | 0.77 | SOAT1 (0.39) | SOAT1S100A4 | |
| SCHEMBL11543271 | 0.73 | DGKA (0.47) | SMN1; SMN2 | |
| SCHEMBL1235894 | 0.70 | GSTP1 (0.43) | GPR84 | |
| SCHEMBL28231896 | 0.69 | ALDH1A1 (0.34) | SOAT1S100A4SMN1; SMN2 | |
| SCHEMBL1237582 | 0.69 | ACHE (0.43) | GPR84 | |
| SCHEMBL20819085 | 0.69 | ACHE (0.43) | GPR84 | |
| SCHEMBL10606425 | 0.69 | GPR84 (0.33) | G6PDSOAT1GPR84 |
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 |
|---|---|---|---|---|---|---|---|
| US-3723531-A | 2-SUBSTITUTED-THIO-2-CYCLOHEXENE-1-ONE AND METHOD FOR PREPARING THEM | RHONE-POULENC, INC., A COP. OF NY | 1973-03-27 | — | — | US | disclosed |