Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CTSL | P07711 | 2/20 | 0.34 |
| ▸ | CTSB | P07858 | 2/20 | 0.34 |
| ▸ | CTSS | P25774 | 2/20 | 0.34 |
| ▸ | CTSK | P43235 | 2/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30789013 | 0.84 | ESR1 (0.42) | ESR1ESR2HTR2ACYP1A2CTSL | |
| SCHEMBL9570698 | 0.81 | ESR1 (0.46) | ESR1ESR2CTSL | |
| SCHEMBL28893969 | 0.79 | ESR1 (0.40) | ESR1ESR2HTR2ACYP1A2CTSL | |
| SCHEMBL9560934 | 0.79 | ESR1 (0.44) | ESR1ESR2CYP1A2 | |
| SCHEMBL9862583 | 0.79 | ESR1 (0.44) | ESR1ESR2 | |
| SCHEMBL17892089 | 0.79 | CYP1A2 (0.38) | HTR2ACYP1A2 | |
| SCHEMBL9570823 | 0.79 | ESR1 (0.44) | ESR1ESR2 | |
| SCHEMBL9570660 | 0.79 | ESR1 (0.44) | ESR1ESR2 | |
| SCHEMBL9570735 | 0.79 | ESR1 (0.44) | ESR1ESR2CTSLCTSBCTSS | |
| SCHEMBL22349242 | 0.78 | ESR1 (0.42) | ESR1ESR2HTR2A |
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 |