Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.32 |
| ▸ | RXRA | P19793 | 1/20 | 0.31 |
| ▸ | RXRB | P28702 | 1/20 | 0.31 |
| ▸ | RXRG | P48443 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 2/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7920480 | 0.77 | — | — | |
| SCHEMBL6970023 | 0.76 | POLB (0.31) | POLBHTTCYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL7920854 | 0.76 | PTGS1 (0.30) | PTGS2PTGS1 | |
| SCHEMBL7922637 | 0.76 | — | — | |
| SCHEMBL9309697 | 0.65 | MAPK1 (0.40) | PTGS2PTGS1RXRARXRBRXRG | |
| SCHEMBL6978102 | 0.64 | — | — | |
| SCHEMBL6978097 | 0.64 | — | — | |
| SCHEMBL9526672 | 0.64 | MAPK1 (0.42) | PTGS2PTGS1RXRARXRBRXRG | |
| SCHEMBL9311365 | 0.64 | ALDH1A1 (0.47) | POLBSMN1; SMN2 | |
| SCHEMBL9309779 | 0.61 | GABRB3 (0.44) | SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6232271-B1 | 1-Methyl-5-alkylsulfonyl-, 1-methyl-5-alkylsulfinyl- and 1-methyl-5-alkylthio- substituted pyrazolylpyrazoles, processes for their preparation and their use as herbicides | HOECHST SCHERING AGREVO GMBH (DE) | 2001-05-15 | — | — | US | disclosed |
| EP-1034165-A1 | PYRAZOLYLPYRAZOLES SUBSTITUTED BY 1-METHYL-5- ALKYLSULPHONYL, 1-METHYL-5- ALKYLSUPHINYL AND 1-METHYL-5- ALKYLTHIO, METHODS FOR PREPARING THEM AND USE AS HERBICIDES | Aventis CropScience GmbH (DE) | 2000-09-13 | — | — | EP | disclosed |
| WO-1999026931-A1 | PYRAZOLYLPYRAZOLES SUBSTITUTED BY 1-METHYL-5- ALKYLSULPHONYL, 1-METHYL-5- ALKYLSUPHINYL AND 1-METHYL-5- ALKYLTHIO, METHODS FOR PREPARING THEM AND USE AS HERBICIDES | AVENTIS CROPSCIENCE GMBH (DE) | 1999-06-03 | — | — | WO | disclosed |