Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of 2-Pyrrolidone. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.34 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.30 |
| ▸ | CRBN | Q96SW2 | 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 | |
|---|---|---|---|---|
| SCHEMBL6543264 | 0.84 | — | — | |
| 2-Pyrrolidone SCHEMBL421593 | 0.73 | OR51E2 (0.33) | OR51E2 | |
| SCHEMBL8984952 | 0.67 | — | — | |
| Sulfuric Acid Dimethyl Ester SCHEMBL11365586 | 0.65 | OR51E2 (0.62) | OR51E2FKBP5CRBN | |
| 2-Pyrrolidone SCHEMBL9518900 | 0.65 | OR51E2 (0.62) | OR51E2FKBP5CRBN | |
| 2-Pyrrolidone SCHEMBL867930 | 0.64 | OR51E2 (0.37) | OR51E2FKBP5CRBN | |
| 2-Pyrrolidone SCHEMBL28284820 | 0.63 | OR51E2 (0.60) | OR51E2FKBP5CRBN | |
| 2-Pyrrolidone SCHEMBL378717 | 0.63 | OR51E2 (0.46) | OR51E2FKBP5CRBN | |
| Sulfuric Acid Dimethyl Ester SCHEMBL10761403 | 0.63 | OR51E2 (0.42) | OR51E2FKBP5CRBN | |
| 2-Pyrrolidone SCHEMBL4966595 | 0.62 | OR51E2 (0.71) | OR51E2FKBP5CRBN |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120074603-A1 | Delivery of Herbicidal Actives From Highly Charged Microcapsules | AQUEA SCIENTIFIC CORPORATION | 2012-03-29 | — | — | US | disclosed |
| EP-2148643-A1 | HIGHLY CHARGED MICROCAPSULES | Aquea Scientific Corporation (US) | 2010-02-03 | — | — | EP | disclosed |
| US-20080317795-A1 | HIGHLY CHARGED MICROCAPSULES | AQUEA SCIENTIFIC CORPORATION | 2008-12-25 | — | — | US | disclosed |
| WO-2008144734-A1 | HIGHLY CHARGED MICROCAPSULES | AQUEA SCIENTIFIC CORPORATION (US) | 2008-11-27 | — | — | WO | disclosed |