Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | CASP1 | P29466 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.45 |
| ▸ | PTPRC | P08575 | 2/20 | 0.43 |
| ▸ | PTPRG | P23470 | 2/20 | 0.43 |
| ▸ | MYC | P01106 | 1/20 | 0.41 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA3 | P07451 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.41 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1061633 | 0.86 | SLC22A12 (0.39) | TSHRCASP1SMN1; SMN2NR1H4PTPRC | |
| SCHEMBL1018464 | 0.85 | TSHR (0.50) | TSHRCASP1SMN1; SMN2NR1H4PTPRC | |
| SCHEMBL9558139 | 0.80 | TSHR (0.61) | TSHRCASP1SMN1; SMN2NR1H4PTPRC | |
| SCHEMBL11702627 | 0.80 | IDO1 (0.48) | TSHRKMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL28306765 | 0.78 | IDO1 (0.47) | TSHRKMT2AMEN1 | |
| SCHEMBL2140516 | 0.78 | TSHR (0.59) | TSHRCASP1SMN1; SMN2NR1H4PTPRC | |
| SCHEMBL543139 | 0.78 | SMN1; SMN2 (0.59) | TSHRCASP1SMN1; SMN2NR1H4PTPRC | |
| SCHEMBL30463143 | 0.78 | SMN1; SMN2 (0.59) | TSHRCASP1SMN1; SMN2NR1H4PTPRC | |
| SCHEMBL11701150 | 0.78 | IDO1 (0.47) | TSHRKMT2AMEN1 | |
| SCHEMBL9391004 | 0.78 | IDO1 (0.47) | TSHRKMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2451778-A1 | STABLE CRYSTALLINE POLYMORPH OF 2-(2-CHLORO-4-MESYL- BENZOYL)-CYCLOHEXANE/-1,3-DIONE AND PROCESS FOR PREPARING THE SAME | Sapec-Agro, Sa (PT) | 2012-05-16 | — | — | EP | disclosed |
| WO-2011005127-A1 | STABLE CRYSTALLINE POLYMORPH OF 2-(2-CHLORO-4-MESYL- BENZOYL)-CYCLOHEXANE/-1,3-DIONE AND PROCESS FOR PREPARING THE SAME | SAPEC-AGRO, SA (PT) | 2011-01-13 | — | — | WO | disclosed |