Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14877461 | 0.75 | GAA (0.37) | CA1CA2TSHRTP53GAA | |
| SCHEMBL6402909 | 0.73 | FAAH (0.40) | FAAHTP53GAAALDH1A1HPGD | |
| SCHEMBL4033195 | 0.73 | CYP3A4 (0.39) | CA1CA2TSHRTP53GAA | |
| SCHEMBL8020503 | 0.72 | TSHR (0.35) | CA1CA2TSHRTP53GAA | |
| SCHEMBL2721962 | 0.71 | TSHR (0.36) | TSHRTP53GAARECQLSMN1; SMN2 | |
| SCHEMBL22468826 | 0.71 | TSHR (0.36) | TSHRTP53GAARECQLSMN1; SMN2 | |
| SCHEMBL29529763 | 0.71 | TSHR (0.36) | TSHRTP53GAARECQLSMN1; SMN2 | |
| SCHEMBL11498167 | 0.70 | L3MBTL1 (0.35) | CA1CA2TSHRTP53GAA | |
| SCHEMBL6475425 | 0.70 | MCL1 (0.41) | CA1CA2TSHRTP53GAA | |
| SCHEMBL10588700 | 0.69 | GAA (0.34) | CA1CA2TSHRTP53GAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0537909-B1 | 3-(Unsubstituted or substituted benzyl)-1-alkyl-2-oxocyclopentane carboxylic acid alkyl ester derivatives, and their preparation and use | KUREHA CHEMICAL IND CO LTD (JP) | 1997-01-22 | — | — | EP | disclosed |
| US-5258404-A | 3-(Unsubstituted or substituted benzyl)-1-alkyl-2-oxocyclopentane carboxylic acid alkyl ester derivatives, method for preparation fungicides, and use thereof as intermediate compounds | KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) | 1993-11-02 | — | — | US | disclosed |
| EP-0537909-A1 | 3-(Unsubstituted or substituted benzyl)-1-alkyl-2-oxocyclopentane carboxylic acid alkyl ester derivatives, and their preparation and use | KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) | 1993-04-21 | — | — | EP | disclosed |