Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 13/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 12/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 12/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 12/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 12/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 12/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 12/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 12/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 12/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 12/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 12/20 | 0.45 |
| ▸ | NCOR2 | Q9Y618 | 12/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL29605222 | 1.00 | CYP2C9 (0.46) | CYP2C9CYP2C19HDAC6HDAC3HDAC4 | |
| SCHEMBL29605477 | 0.91 | HDAC6 (0.48) | CYP2C9CYP2C19HDAC6HDAC3HDAC4 | |
| SCHEMBL29110752 | 0.91 | HDAC6 (0.48) | CYP2C9CYP2C19HDAC6HDAC3HDAC4 | |
| SCHEMBL29606339 | 0.90 | CYP2C9 (0.52) | CYP2C9CYP2C19HDAC6HDAC3HDAC4 | |
| SCHEMBL29110790 | 0.90 | CYP2C9 (0.52) | CYP2C9CYP2C19HDAC6HDAC3HDAC4 | |
| SCHEMBL29110806 | 0.89 | HDAC6 (0.50) | CYP2C9CYP2C19HDAC6HDAC3HDAC4 | |
| SCHEMBL29607167 | 0.89 | HDAC6 (0.50) | CYP2C9CYP2C19HDAC6HDAC3HDAC4 | |
| SCHEMBL29605204 | 0.89 | HDAC1 (0.48) | CYP2C9CYP2C19HDAC6HDAC3HDAC4 | |
| SCHEMBL29110777 | 0.89 | HDAC1 (0.48) | CYP2C9CYP2C19HDAC6HDAC3HDAC4 | |
| SCHEMBL29110787 | 0.87 | HDAC6 (0.46) | CYP2C9CYP2C19HDAC6HDAC3HDAC4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114621194-B | 4-methylene-N-hydroxybenzoamide compound and application thereof | 沈阳药科大学 | 2023-08-29 | — | — | CN | disclosed |