Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 13/20 | 0.64 |
| ▸ | HDAC2 | Q92769 | 9/20 | 0.61 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.61 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL2108411 | 0.91 | HDAC1 (0.74) | HDAC1HDAC2HDAC3 | |
| SCHEMBL1689203 | 0.91 | HDAC1 (0.60) | HDAC1HDAC2HDAC3 | |
| SCHEMBL1689174 | 0.89 | HDAC1 (0.67) | HDAC1HDAC2HDAC3 | |
| SCHEMBL1689363 | 0.87 | HDAC1 (0.82) | HDAC1HDAC2HDAC3 | |
| SCHEMBL2107623 | 0.84 | HDAC1 (0.68) | HDAC1HDAC2HDAC3 | |
| SCHEMBL1689223 | 0.83 | HDAC1 (0.71) | HDAC1HDAC2HDAC3 | |
| SCHEMBL2108793 | 0.82 | HDAC2 (0.65) | HDAC1HDAC2HDAC3 | |
| SCHEMBL1689215 | 0.81 | HDAC2 (0.75) | HDAC1HDAC2HDAC3 | |
| SCHEMBL1689148 | 0.80 | HDAC1 (0.59) | HDAC1HDAC2HDAC3KCNH2 | |
| SCHEMBL18653509 | 0.79 | HDAC2 (0.75) | HDAC1HDAC2HDAC3 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1896395-B1 | MODIFIED MALONATE DERIVATIVES | MERCK SHARP & DOHME (US) | 2015-07-15 | — | — | EP | claimed |
| US-8158825-B2 | Modified malonate derivatives | MERCK SHARP & DOHME CORP. (US) | 2012-04-17 | — | — | US | claimed |
| EP-1896395-A2 | MODIFIED MALONATE DERIVATIVES | Merck & Co., Inc. (US) | 2008-03-12 | — | — | EP | claimed |
| WO-2007002248-A2 | MODIFIED MALONATE DERIVATIVES | MERCK & CO., INC. (US) | 2007-01-04 | — | — | WO | claimed |
| EP-1896395-A2 | MODIFIED MALONATE DERIVATIVES | Merck & Co., Inc. (US) | 2008-03-12 | — | — | EP | disclosed |
| WO-2007002248-A2 | MODIFIED MALONATE DERIVATIVES | MERCK & CO., INC. (US) | 2007-01-04 | — | — | WO | disclosed |