Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL31695088 | 0.87 | CYP2C19 (0.39) | CYP3A4ALDH1A1TSHR | |
| SCHEMBL5180173 | 0.87 | CYP2C19 (0.39) | CYP3A4ALDH1A1TSHR | |
| SCHEMBL10954179 | 0.86 | ALDH1A1 (0.30) | ALDH1A1TSHR | |
| SCHEMBL10954184 | 0.86 | ALDH1A1 (0.30) | ALDH1A1TSHR | |
| SCHEMBL9732373 | 0.83 | CYP2C19 (0.34) | CYP3A4ALDH1A1NPSR1KDM4ETSHR | |
| SCHEMBL25619136 | 0.82 | CYP2C19 (0.36) | CYP3A4ALDH1A1TSHR | |
| SCHEMBL1137710 | 0.82 | CYP2C19 (0.36) | CYP3A4ALDH1A1TSHR | |
| SCHEMBL18101495 | 0.82 | TSHR (0.33) | CYP3A4ALDH1A1TSHR | |
| SCHEMBL10798085 | 0.82 | TSHR (0.42) | CYP3A4ALDH1A1HPGDTSHR | |
| SCHEMBL7624802 | 0.81 | CYP2C19 (0.35) | CYP3A4ALDH1A1KDM4ETSHR |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0712836-A1 | Alkyl 3-benzylidene-1-alkyl-2-oxocyclopentanecarboxylate derivates as fungicides | KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) | 1996-05-22 | — | — | EP | claimed |
| JP-7082219-A | — | — | None | — | — | JP | disclosed |
| JP-56142232-A | — | — | None | — | — | JP | disclosed |
| EP-0712836-A1 | Alkyl 3-benzylidene-1-alkyl-2-oxocyclopentanecarboxylate derivates as fungicides | KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) | 1996-05-22 | — | — | EP | disclosed |
| US-5519160-A | FUNGICIDES | KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) | 1996-05-21 | — | — | US | disclosed |
| JP-H0782219-A | 3-(UNSUBSTITUTED OR SUBSTITUTED BENZYLIDENE)-1-ALKYL-2-OXOCYCLOPENTANECARBOXYLIC ACID ALKYL ESTER DERIVATIVE, ITS PRODUCTION AND ITS USE AS FUNGICIDE AND INTERMEDIATE | KUREHA CHEM IND CO LTD | 1995-03-28 | — | — | JP | 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 |
| JP-S56142232-A | PREPARATION OF 2-ALKYL-4-CYCLOPENTEN-1-ONE | AGENCY OF IND SCIENCE & TECHNOL | 1981-11-06 | — | — | JP | disclosed |