Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.43 |
| ▸ | TDO2 | P48775 | 1/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MGAM | O43451 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | SI | P14410 | 1/20 | 0.38 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | AHR | P35869 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28395878 | 0.80 | MAPK14 (0.52) | RAB9APRKCZTDO2MAP4K4PTGS2 | |
| SCHEMBL2231313 | 0.78 | ALDH1A1 (0.47) | RAB9AKMT2AMEN1PRKCZNPC1 | |
| SCHEMBL547061 | 0.77 | CYP2A6 (0.50) | RAB9AKMT2AMEN1PRKCZTDO2 | |
| SCHEMBL544047 | 0.77 | BCAT2 (0.52) | RAB9AKMT2AMEN1PRKCZTDO2 | |
| SCHEMBL28990420 | 0.76 | DHFR (0.50) | RAB9AKMT2AMEN1TDO2NPC1 | |
| SCHEMBL8143238 | 0.74 | MEN1 (0.33) | KMT2AMEN1PTGS2ALDH1A1MAPT | |
| SCHEMBL28914110 | 0.74 | NPC1 (0.50) | RAB9AKMT2ANPC1PTGS2KDM4E | |
| SCHEMBL16048484 | 0.71 | NOTUM (0.40) | KMT2APRKCZPTGS2NOTUMALDH1A1 | |
| SCHEMBL847406 | 0.71 | — | — | |
| SCHEMBL7457943 | 0.70 | CASP3 (0.41) | RAB9AKMT2AMEN1NPC1PTGS2 |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117069763-A | Ionic liquid catalyst and preparation method and application thereof | 西安科技大学 | 2023-11-17 | — | — | CN | claimed |
| CN-111187233-B | Polysubstituted benzothiazole and derivative and synthesis method thereof | 湘潭大学 | 2023-05-30 | — | — | CN | claimed |
| CN-117715907-A | 10-substituted-1-azaphenothiazine derivative and application thereof | 华东理工大学 | 2024-03-15 | — | — | CN | disclosed |
| CN-117069763-A | Ionic liquid catalyst and preparation method and application thereof | 西安科技大学 | 2023-11-17 | — | — | CN | disclosed |
| CN-116987047-A | Heterocyclic oxime compound, preparation method, application and composition thereof | 贵州大学 | 2023-11-03 | — | — | CN | disclosed |
| CN-116969969-A | Nitrogen-containing compound, organic electroluminescent device and electronic device | 陕西莱特光电材料股份有限公司 | 2023-10-31 | — | — | CN | disclosed |
| CN-116568677-A | piperidin-1-yl-N-pyridin-3-yl-2-oxoacetamide derivatives useful for the treatment of MTAP deficiency and/or MTA accumulating cancers | 探戈医药股份有限公司 | 2023-08-08 | — | — | CN | disclosed |
| CN-111187233-B | Polysubstituted benzothiazole and derivative and synthesis method thereof | 湘潭大学 | 2023-05-30 | — | — | CN | disclosed |
| CN-111072594-B | Preparation method of 2-aryl benzothiazole compound | 东华理工大学 | 2023-05-05 | — | — | CN | disclosed |
| EP-0737682-B1 | Substituted thiophene derivative and agricultural and horticultural fungicide containing the same as active ingredient | MITSUI CHEMICALS INC (JP) | 2002-01-09 | — | — | EP | disclosed |
| CN-1061657-C | Substituted thiophene derivative and agricultural and horticultural fungicide containing the same as active ingredient | MITSUI TOATSU CHEMICALS (JP) | 2001-02-07 | — | — | CN | disclosed |
| US-5747518-A | EFFECTIVE AGAINST CHEMICAL RESISTANT FUNGI; NONPHYTOTOXIC TO CROPS | MITSUI TOATSU CHEMICALS, INC. (JP) | 1998-05-05 | — | — | US | disclosed |
| CN-1146993-A | Substituted thiophene derivative and agricultural and horticultural fungicide containing the same as active ingredient | MITSUI TOATSU CHEMICALS (JP) | 1997-04-09 | — | — | CN | disclosed |
| EP-0737682-A1 | Substituted thiophene derivative and agricultural and horticultural fungicide containing the same as active ingredient | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1996-10-16 | — | — | EP | disclosed |