Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 8/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | SOAT1 | P35610 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28835923 | 0.99 | CHRM3 (0.35) | PTPN1KDM4ECHRM3ALDH1A1MEN1 | |
| SCHEMBL28836033 | 0.84 | MEN1 (0.35) | KDM4ECHRM3ALDH1A1MEN1MAPT | |
| SCHEMBL28835979 | 0.79 | CYP1A2 (0.32) | KDM4EALDH1A1MEN1MAPTCYP2C9 | |
| SCHEMBL28835982 | 0.74 | MEN1 (0.33) | KDM4EALDH1A1MEN1MAPTCYP2C9 | |
| SCHEMBL28835983 | 0.71 | MEN1 (0.35) | KDM4ECHRM3ALDH1A1MEN1MAPT | |
| SCHEMBL28836036 | 0.64 | HTT (0.34) | CHRM3ALDH1A1MEN1CYP2C9CYP2C19 | |
| SCHEMBL7788909 | 0.63 | NR5A1 (0.36) | PTPN1CHRM3CNR2ALDH1A1MEN1 | |
| SCHEMBL29779547 | 0.62 | — | — | |
| SCHEMBL9494241 | 0.61 | NR5A1 (0.34) | PTPN1ALDH1A1MEN1CYP2C9CYP2C19 | |
| SCHEMBL28581527 | 0.61 | PDE4B (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-115010600-B | Method for synthesizing polyfluoroaryl carboxylic acid compound based on aryl fluorocarbon bond carboxylation reaction | 四川大学 | 2023-11-17 | — | — | CN | disclosed |
| CN-115010600-A | Method for synthesizing polyfluoroaryl carboxylic acid compounds based on aryl fluorocarbon bond carboxylation reaction | 四川大学 | 2022-09-06 | — | — | CN | disclosed |