Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 14/20 | 0.58 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.56 |
| ▸ | DHPS | P49366 | 1/20 | 0.45 |
| ▸ | PRSS12 | P56730 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3575662 | 0.92 | HDAC1 (0.60) | HDAC1HDAC2DHPS | |
| SCHEMBL3814883 | 0.90 | HDAC1 (0.60) | HDAC1HDAC2DHPS | |
| SCHEMBL3810635 | 0.90 | HDAC1 (0.58) | HDAC1HDAC2 | |
| SCHEMBL3819259 | 0.88 | HDAC1 (0.55) | HDAC1HDAC2 | |
| SCHEMBL3820750 | 0.86 | HDAC1 (0.63) | HDAC1HDAC2DHPS | |
| SCHEMBL3820287 | 0.85 | HDAC1 (0.56) | HDAC1HDAC2 | |
| SCHEMBL3565708 | 0.85 | HDAC1 (0.71) | HDAC1HDAC2 | |
| SCHEMBL5051806 | 0.84 | HDAC1 (0.57) | HDAC1HDAC2DHPS | |
| SCHEMBL3570046 | 0.84 | HDAC1 (0.60) | HDAC1HDAC2DHPS | |
| SCHEMBL3579612 | 0.83 | HDAC2 (0.70) | HDAC1HDAC2PRSS12 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1874295-A4 | BENZOTHIOPHENE DERIVATIVES | MERCK & CO INC (US) | 2009-08-12 | — | — | EP | disclosed |
| EP-1874295-A1 | BENZOTHIOPHENE DERIVATIVES | Merck & Co., Inc. (US) | 2008-01-09 | — | — | EP | disclosed |
| WO-2006115845-A1 | BENZOTHIOPHENE DERIVATIVES | MERCK & CO., INC. (US) | 2006-11-02 | — | — | WO | disclosed |