Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | PDE2A | O00408 | 3/20 | 0.33 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.32 |
| ▸ | IDH1 | O75874 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
| ▸ | SYK | P43405 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30363265 | 0.78 | GAA (0.39) | GAACYP2C19CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL21803008 | 0.74 | KCNH2 (0.32) | KCNH2GRIN2B | |
| SCHEMBL27596771 | 0.74 | GAA (0.43) | GAACYP2C19CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL29718799 | 0.74 | GAA (0.40) | GAACYP2C19CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL3329152 | 0.72 | CYP2C19 (0.43) | GAACYP2C19CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL1406152 | 0.72 | GAA (0.49) | GAACYP2C19CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL27596801 | 0.72 | GAA (0.49) | GAACYP2C19CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL27615388 | 0.72 | GAA (0.49) | GAACYP2C19CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL15730588 | 0.72 | GAA (0.38) | GAACYP2C19CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL3730626 | 0.71 | GAA (0.48) | GAACYP2C19CYP3A4CYP1A2CYP2C9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119504590-A | 1-Methyl-3-trifluoromethyl-4-chloromethyl-5-difluoromethoxy-1-H-pyrazole and preparation method thereof | 鹤壁市宝瑞德化工有限公司 | 2025-02-25 | — | — | CN | disclosed |
| CN-119318925-A | Continuous production system and continuous production method of 5- (difluoromethoxy) -4-chloromethyl-1-methyl-3- (trifluoromethyl) -1H-pyrazole | 天津凯莱英医药科技发展有限公司 | 2025-01-17 | — | — | CN | disclosed |
| WO-2024209278-A1 | A PROCESS FOR THE PREPARATION OF PYROXASULFONE | GHARDA CHEMICALS LIMITED (IN) | 2024-10-10 | — | — | WO | disclosed |