Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 6/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | YEATS4 | O95619 | 1/20 | 0.47 |
| ▸ | MLYCD | O95822 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.45 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2202532 | 0.89 | HPGD (0.59) | L3MBTL3L3MBTL1HDAC6HDAC1CYP2C9 | |
| SCHEMBL17707579 | 0.85 | HDAC6 (0.56) | L3MBTL3L3MBTL1HDAC6HDAC1CYP2C9 | |
| SCHEMBL2204285 | 0.81 | HDAC6 (0.55) | L3MBTL3L3MBTL1HDAC6HDAC1CYP2C9 | |
| SCHEMBL2204120 | 0.81 | HDAC6 (0.55) | L3MBTL3L3MBTL1HDAC6HDAC1CYP2C9 | |
| SCHEMBL2202147 | 0.80 | ALDH1A1 (0.60) | HDAC6HDAC1CYP2C9HDAC3ALDH1A1 | |
| SCHEMBL2200890 | 0.78 | ALDH1A1 (0.61) | HDAC6HDAC1CYP2C9HDAC3HPGD | |
| SCHEMBL17707597 | 0.77 | L3MBTL3 (0.61) | L3MBTL3L3MBTL1HDAC6HDAC1CYP2C9 | |
| SCHEMBL2200435 | 0.75 | HDAC6 (0.59) | L3MBTL3L3MBTL1HDAC6HDAC1CYP2C9 | |
| Trifluoroacetic Acid SCHEMBL2203749 | 0.74 | L3MBTL1 (0.57) | L3MBTL3L3MBTL1HDAC6HDAC1CYP2C9 | |
| SCHEMBL2203217 | 0.74 | HDAC6 (0.52) | L3MBTL3L3MBTL1HDAC6HDAC1CYP2C9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1926721-B1 | THIOPHENE AND THIAZOLE SUBSTITUTED TRIFLUOROETHANONE DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS | MSD ITALIA SRL (IT) | 2016-05-04 | — | — | EP | claimed |
| EP-1926721-B1 | THIOPHENE AND THIAZOLE SUBSTITUTED TRIFLUOROETHANONE DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS | MSD ITALIA SRL (IT) | 2016-05-04 | — | — | EP | disclosed |
| EP-1926721-A2 | THIOPHENE AND THIAZOLE SUBSTITUTED TRIFLUOROETHANONE DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS | Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) | 2008-06-04 | — | — | EP | disclosed |
| WO-2007029035-A2 | THIOPHENE AND THIAZOLE SUBSTITUTED TRIFLUOROETHANONE DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) | 2007-03-15 | — | — | WO | disclosed |