Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.45 |
| ▸ | CES1 | P23141 | 2/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | NAAA | Q02083 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.41 |
| ▸ | ACER2 | Q5QJU3 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5275294 | 0.95 | NAAA (0.44) | CES2CES1HDAC8HDAC3HDAC6 | |
| SCHEMBL3678714 | 0.94 | HDAC8 (0.41) | CES2CES1HDAC8HDAC3HDAC6 | |
| SCHEMBL8961584 | 0.91 | L3MBTL1 (0.44) | CES2CES1HDAC8HDAC3HDAC6 | |
| SCHEMBL3678718 | 0.86 | L3MBTL1 (0.40) | CES2CES1HDAC8HDAC3HDAC6 | |
| SCHEMBL98957 | 0.84 | CES1 (0.60) | CES2CES1HDAC8HDAC3HDAC6 | |
| SCHEMBL599772 | 0.84 | CES1 (0.60) | CES2CES1HDAC8HDAC3HDAC6 | |
| SCHEMBL7760638 | 0.84 | CES1 (0.60) | CES2CES1HDAC8HDAC3HDAC6 | |
| SCHEMBL875304 | 0.84 | CES1 (0.60) | CES2CES1HDAC8HDAC3HDAC6 | |
| SCHEMBL599568 | 0.84 | CES1 (0.60) | CES2CES1HDAC8HDAC3HDAC6 | |
| SCHEMBL6552354 | 0.84 | CES1 (0.60) | CES2CES1HDAC8HDAC3HDAC6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0507013-B1 | Process for the preparation of aromatic beta-diketones | WITCO CORP (US) | 1996-02-07 | — | — | EP | disclosed |
| EP-0507013-A1 | Process for the preparation of aromatic beta-diketones | WITCO CORPORATION (US) | 1992-10-07 | — | — | EP | disclosed |