Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL6508201 | 0.90 | CYP2C19 (0.31) | CYP2C19HIF1A | |
| SCHEMBL6505272 | 0.88 | CYP2C19 (0.39) | CYP2C19HIF1A | |
| SCHEMBL5518734 | 0.87 | CYP2C19 (0.40) | CYP2C19HIF1A | |
| SCHEMBL5526988 | 0.83 | CYP2C19 (0.41) | CYP2C19HIF1A | |
| SCHEMBL6430080 | 0.82 | CYP2C19 (0.36) | CYP2C19HIF1A | |
| SCHEMBL6700913 | 0.81 | CYP2C19 (0.38) | CYP2C19HIF1A | |
| SCHEMBL19678187 | 0.81 | ACACB (0.39) | CYP2C19HIF1A | |
| SCHEMBL19678190 | 0.80 | ACACB (0.37) | CYP2C19HIF1A | |
| SCHEMBL6698317 | 0.80 | CYP2C19 (0.39) | CYP2C19HIF1A | |
| SCHEMBL19678167 | 0.80 | CYP2C19 (0.37) | CYP2C19HIF1A |
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-6673780-B2 | SUCH AS 4-(4-(3-HYDROXY-3-METHYL-BUTANE-1-SULFINYLMETHYL)-PHENYLMETHANESULFINYL)-2 -METHYL-BUTAN1-OL FOR TREATING AND PREVENTING CARDIOVASCULAR DISEASES, DYSLIPIDEMIAS, DYSPROTEINEMIAS, AND GLUCOSE METABOLISM DISORDERS | ESPERION THERAPEUTICS, INC. | 2004-01-06 | — | — | US | disclosed |