Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CDC25B | P30305 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.40 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Diethyl Phthalate SCHEMBL28191734 | 0.78 | TSHR (0.53) | TSHRALDH1A1HSD17B10KDM4ECYP3A4 | |
| Ethyl Anthranilate SCHEMBL4956191 | 0.75 | ALDH1A1 (0.56) | TSHRALDH1A1HSD17B10KDM4ECYP3A4 | |
| SCHEMBL7809969 | 0.75 | L3MBTL1 (0.42) | HSD17B10KDM4ETDP1L3MBTL1MAPK1 | |
| Diethyl Phthalate SCHEMBL28329107 | 0.74 | TSHR (0.81) | TSHRALDH1A1HSD17B10KDM4ECYP3A4 | |
| Diethyl Phthalate SCHEMBL28124298 | 0.74 | TSHR (0.81) | TSHRALDH1A1HSD17B10KDM4ECYP3A4 | |
| SCHEMBL8338114 | 0.74 | MEN1 (0.41) | ALDH1A1CYP3A4 | |
| SCHEMBL113015 | 0.74 | MEN1 (0.41) | ALDH1A1CYP3A4 | |
| SCHEMBL29192 | 0.74 | MEN1 (0.41) | ALDH1A1CYP3A4 | |
| Alcohol SCHEMBL7209873 | 0.73 | MEN1 (0.38) | ALDH1A1CYP3A4 | |
| Diethyl Phthalate SCHEMBL27586947 | 0.72 | TSHR (0.91) | TSHRALDH1A1HSD17B10KDM4ECYP3A4 |
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-1113782-A1 | USE OF MENTHYL-2-PYRROLIDONE-5-CARBOXYLATE AS AN INSECT REPELLENT | QUEST INTERNATIONAL B.V. (NL) | 2001-07-11 | — | — | EP | disclosed |
| WO-2000016738-A1 | USE OF MENTHYL-2-PYRROLIDONE-5-CARBOXYLATE AS AN INSECT REPELLENT | QUEST INTERNATIONAL B.V. (NL) | 2000-03-30 | — | — | WO | disclosed |