Known targets — ChEMBL curated mechanism
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
The experimentally established mechanism targets of Ether. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | MGAM | O43451 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | SI | P14410 | 1/20 | 0.30 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.30 |
| ▸ | SOAT1 | P35610 | 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 | |
|---|---|---|---|---|
| Ether SCHEMBL38466 | 0.97 | CA5A (0.43) | CA5ACA5BALDH1A1TP53CA2 | |
| Ether SCHEMBL27570944 | 0.97 | CA5A (0.43) | CA5ACA5BALDH1A1TP53CA2 | |
| Ether SCHEMBL7991028 | 0.93 | CA5A (0.40) | CA5ACA5BALDH1A1TP53CA2 | |
| Ether SCHEMBL1095738 | 0.93 | CA5A (0.40) | CA5ACA5BALDH1A1TP53CA2 | |
| Ether SCHEMBL28102344 | 0.93 | CA5A (0.40) | CA5ACA5BALDH1A1TP53CA2 | |
| Ether SCHEMBL9221305 | 0.93 | CA5A (0.40) | CA5ACA5BALDH1A1TP53CA2 | |
| Ether SCHEMBL828632 | 0.93 | CA5A (0.40) | CA5ACA5BALDH1A1TP53CA2 | |
| Ether SCHEMBL19813170 | 0.93 | CA5A (0.40) | CA5ACA5BALDH1A1TP53CA2 | |
| Ether SCHEMBL739042 | 0.90 | ALDH1A1 (0.43) | CA5ACA5BALDH1A1TP53CA2 | |
| Ether SCHEMBL27956424 | 0.90 | ALDH1A1 (0.36) | ALDH1A1TP53CA2CA1TSHR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9215868-B2 | Low-foam preparations for crop protection | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2015-12-22 | — | — | US | disclosed |
| US-20140121285-A1 | Low-Foam Preparations for Crop Protection | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2014-05-01 | — | — | US | disclosed |
| US-8637432-B2 | Low-foam preparations for crop protection | BAYER CROPSCIENCE AG (DE) | 2014-01-28 | — | — | US | disclosed |
| US-20080045415-A1 | Low-Foam Preparations for Crop Protection | BAYER CROPSCIENCE AG (DE) | 2008-02-21 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20080045415-A1 | Low-Foam Preparations for Crop Protection | AGPS, MGLL, GYS2 | CA5A 4463/4885CA5B 4654/4885ALDH1A1 3820/4885 |
| US-20140121285-A1 | Low-Foam Preparations for Crop Protection | AGPS, MGLL, GYS2 | CA5A 4463/4885CA5B 4654/4885ALDH1A1 3820/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.