Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 7/20 | 0.61 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.61 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.58 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.56 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | CASP1 | P29466 | 1/20 | 0.55 |
| ▸ | CASP7 | P55210 | 1/20 | 0.55 |
| ▸ | HBB | P68871 | 1/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.54 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.52 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.52 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.52 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL4312882 | 1.00 | ESR1 (0.61) | ESR1ESR2ALOX5HSD17B1HSD17B2 | |
| SCHEMBL4620954 | 1.00 | ESR1 (0.61) | ESR1ESR2ALOX5HSD17B1HSD17B2 | |
| SCHEMBL14994162 | 0.97 | ESR1 (0.65) | ESR1ESR2ALOX5HSD17B1HSD17B2 | |
| SCHEMBL30177479 | 0.97 | ESR1 (0.65) | ESR1ESR2ALOX5HSD17B1HSD17B2 | |
| SCHEMBL3424690 | 0.97 | ESR1 (0.65) | ESR1ESR2ALOX5HSD17B1HSD17B2 | |
| SCHEMBL15842052 | 0.97 | ESR1 (0.65) | ESR1ESR2ALOX5HSD17B1HSD17B2 | |
| SCHEMBL1527556 | 0.92 | ESR1 (0.64) | ESR1ESR2ALOX5HSD17B1HSD17B2 | |
| SCHEMBL30177515 | 0.92 | ESR1 (0.64) | ESR1ESR2ALOX5HSD17B1HSD17B2 | |
| SCHEMBL1310968 | 0.92 | ESR1 (0.64) | ESR1ESR2ALOX5HSD17B1HSD17B2 | |
| SCHEMBL17443014 | 0.92 | ESR1 (0.64) | ESR1ESR2ALOX5HSD17B1HSD17B2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10696685-B2 | Polyketides, methods of use and preparation | UNIVERSITEIT LEIDEN (NL) | 2020-06-30 | — | — | US | disclosed |
| US-20190194217-A1 | Polyketides, Methods of Use and Preparation | UNIVERSITEIT LEIDEN (NL) | 2019-06-27 | — | — | 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-10696685-B2 | Polyketides, methods of use and preparation | COASY, DHPS, PHYKPL | ESR1 4706/4885ESR2 4223/4885ALOX5 2096/4885 |
| US-20190194217-A1 | Polyketides, Methods of Use and Preparation | COASY, DHPS, PHYKPL | ESR1 4706/4885ESR2 4223/4885ALOX5 2096/4885 |
“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.