Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 3/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.31 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.30 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 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 | |
|---|---|---|---|---|
| SCHEMBL9570785 | 0.79 | ESR1 (0.46) | ALDH1A1ESR1ESR2TSHR | |
| SCHEMBL9570698 | 0.76 | ESR1 (0.46) | ESR1ESR2 | |
| SCHEMBL9570912 | 0.76 | CA12 (0.41) | ALDH1A1ESR1ESR2CHRNB2CHRNB4 | |
| SCHEMBL9570823 | 0.75 | ESR1 (0.44) | ALDH1A1ESR1ESR2 | |
| SCHEMBL9560934 | 0.75 | ESR1 (0.44) | ESR1ESR2TDP1TSHR | |
| SCHEMBL9862583 | 0.75 | ESR1 (0.44) | ESR1ESR2 | |
| SCHEMBL9570735 | 0.75 | ESR1 (0.44) | ALDH1A1ESR1ESR2TDP1CHRNA7 | |
| SCHEMBL9570729 | 0.75 | ESR1 (0.44) | ESR1ESR2 | |
| SCHEMBL9570660 | 0.75 | ESR1 (0.44) | ESR1ESR2 | |
| SCHEMBL3138366 | 0.74 | ALDH1A1 (0.50) | ALDH1A1ESR1ESR2TDP1HSD17B2 |
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-0545891-A2 | Aldehyde compounds and derivatives thereof useful as intermediates in the preparation of insectical ether compounds | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1993-06-09 | — | — | EP | disclosed |
| US-4840971-A | INSECTICIDES, MITICIDES | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1989-06-20 | — | — | US | disclosed |
| EP-0240978-A2 | Ether compounds, process for their preparation, compositions containing the same and use thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1987-10-14 | — | — | EP | disclosed |