Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | CES2 | O00748 | 3/20 | 0.46 |
| ▸ | CES1 | P23141 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | PKM | P14618 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.42 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9732502 | 0.83 | CES2 (0.61) | ALDH1A1CES2CES1LMNASMN1; SMN2 | |
| SCHEMBL711850 | 0.82 | CES2 (0.48) | ALDH1A1CES2CES1LMNASMN1; SMN2 | |
| SCHEMBL1115093 | 0.80 | CES2 (0.46) | ALDH1A1CES2CES1LMNASMN1; SMN2 | |
| SCHEMBL2699118 | 0.80 | CES2 (0.46) | CES2CES1LMNAMEN1KMT2A | |
| SCHEMBL709890 | 0.79 | CES2 (0.52) | ALDH1A1CES2CES1LMNAMEN1 | |
| SCHEMBL9770879 | 0.79 | ALDH1A1 (0.50) | ALDH1A1LMNASMN1; SMN2HTTTDP1 | |
| SCHEMBL8220499 | 0.79 | PLK1 (0.46) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL523477 | 0.79 | TDP1 (0.48) | ALDH1A1CES2CES1LMNASMN1; SMN2 | |
| SCHEMBL9565954 | 0.78 | TDP1 (0.47) | ALDH1A1CES2CES1LMNASMN1; SMN2 | |
| SCHEMBL9770764 | 0.77 | SMN1; SMN2 (0.47) | ALDH1A1LMNASMN1; SMN2HTTATM |
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 |
|---|---|---|---|---|---|---|---|
| CN-111423375-A | Preparation method of COX-2 specific cyclooxygenase inhibitor | 云南大学 | 2020-07-17 | — | — | CN | claimed |
| CN-116947618-B | Novel beta-diketone compound and preparation method and application thereof | 重庆康普化学工业股份有限公司 | 2025-03-11 | — | — | CN | disclosed |
| CN-116947618-A | Novel beta-diketone compound and preparation method and application thereof | 重庆康普化学工业股份有限公司 | 2023-10-27 | — | — | CN | disclosed |
| CN-111423375-A | Preparation method of COX-2 specific cyclooxygenase inhibitor | 云南大学 | 2020-07-17 | — | — | CN | disclosed |
| CN-111423375-A | Preparation method of COX-2 specific cyclooxygenase inhibitor | 云南大学 | 2020-07-17 | — | — | CN | disclosed |
| US-5006254-A | Extraction with halogenated beta-diketone | RHONE-POULENC CHIMIE (FR) | 1991-04-09 | — | — | US | disclosed |