Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.45 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.45 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.45 |
| ▸ | ACACB | O00763 | 2/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20395565 | 0.91 | CYP3A4 (0.49) | ALDH1A1CYP3A4CA2TDP1LMNA | |
| SCHEMBL156736 | 0.89 | TDP1 (0.60) | ALDH1A1CYP3A4CA2TDP1LMNA | |
| SCHEMBL490780 | 0.86 | ALDH1A1 (0.53) | ALDH1A1CYP3A4CA2TDP1LMNA | |
| SCHEMBL20395524 | 0.82 | LMNA (0.47) | ALDH1A1CYP3A4CA2TDP1LMNA | |
| SCHEMBL2437306 | 0.82 | ALDH1A1 (0.46) | ALDH1A1CYP3A4CA2TDP1LMNA | |
| SCHEMBL12869942 | 0.82 | TDP1 (0.46) | ALDH1A1CYP3A4CA2TDP1LMNA | |
| SCHEMBL20395678 | 0.81 | ALDH1A1 (0.45) | ALDH1A1CYP3A4CA2TDP1LMNA | |
| SCHEMBL490788 | 0.80 | LMNA (0.52) | ALDH1A1CYP3A4CA2TDP1LMNA | |
| SCHEMBL491043 | 0.80 | TDP1 (0.52) | ALDH1A1CYP3A4CA2TDP1LMNA | |
| SCHEMBL490714 | 0.78 | LDHA (0.56) | ALDH1A1CYP3A4CA2TDP1LMNA |
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-20180207080-A1 | COMPOSITIONS OF FLUORINATED SURFACTANTS AND ANTIOXIDANTS | MERCK PATENT GMBH (DE) | 2018-07-26 | — | — | 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-20180207080-A1 | COMPOSITIONS OF FLUORINATED SURFACTANTS AND ANTIOXIDANTS | LPO, CAT, GPX4 | ALDH1A1 1313/4885CYP3A4 2870/4885CA2 3386/4885 |
“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.