Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | PRKCA | P17252 | 1/20 | 0.32 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL7573130 | 0.90 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL13588978 | 0.86 | ALDH1A1 (0.34) | ALDH1A1TSHR | |
| SCHEMBL8277389 | 0.85 | — | — | |
| SCHEMBL1258974 | 0.85 | ALDH1A1 (0.39) | ALDH1A1NFKB1 | |
| Hexadecane SCHEMBL6009418 | 0.84 | ALDH1A1 (0.42) | ALDH1A1 | |
| SCHEMBL12753879 | 0.83 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL11690998 | 0.83 | TSHR (0.35) | ALDH1A1TSHR | |
| SCHEMBL14060689 | 0.83 | GSR (0.34) | ALDH1A1 | |
| SCHEMBL402444 | 0.83 | ALDH1A1 (0.38) | ALDH1A1TSHR | |
| SCHEMBL14394578 | 0.81 | PTGS2 (0.36) | ALDH1A1 |
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-8658818-B2 | Methods of producing nitrate esters | ALLIANT TECHSYSTEMS INC. (US) | 2014-02-25 | — | — | US | disclosed |
| US-20120130115-A1 | METHODS OF PRODUCING NITRATE ESTERS | ALLIANT TECHSYSTEMS INC. (US) | 2012-05-24 | — | — | 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-20120130115-A1 | METHODS OF PRODUCING NITRATE ESTERS | TST, GMNN, TTN | ALDH1A1 954/4885TSHR 3264/4885PRKCA 2801/4885 |
“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.