Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL17640860 | 0.95 | CYP2C19 (0.36) | CYP2C19POLBBLMATMALDH1A1 | |
| SCHEMBL28325513 | 0.79 | CYP2C19 (0.36) | CYP2C19POLBBLMATM | |
| SCHEMBL14713463 | 0.77 | CYP2C19 (0.34) | CYP2C19POLBBLMATMALDH1A1 | |
| SCHEMBL13395969 | 0.77 | TRPA1 (0.35) | CYP2C19POLBBLMATMALDH1A1 | |
| SCHEMBL19789672 | 0.74 | — | — | |
| SCHEMBL12710486 | 0.72 | — | — | |
| SCHEMBL27972087 | 0.72 | CYP2C19 (0.31) | CYP2C19POLBBLMATM | |
| SCHEMBL14296502 | 0.70 | CYP2C19 (0.33) | CYP2C19POLBBLMATM | |
| SCHEMBL764245 | 0.67 | — | — | |
| SCHEMBL13212714 | 0.67 | TSHR (0.44) | CYP2C19POLBBLMATMALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20180127363-A1 | LIQUID THIOETHER CARBOXYLIC ACID ESTERS | BASF SE (DE) | 2018-05-10 | — | — | 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 (1 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-20180127363-A1 | LIQUID THIOETHER CARBOXYLIC ACID ESTERS | ALAD, TIPRL, CA7 | CYP2C19 1816/4885POLB 4385/4885BLM 4845/4885 |
“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.