Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.69 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.69 |
| ▸ | TSHR | P16473 | 5/20 | 0.69 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.69 |
| ▸ | HTT | P42858 | 2/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.69 |
| ▸ | MAPK1 | P28482 | 6/20 | 0.68 |
| ▸ | TP53 | P04637 | 2/20 | 0.68 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.68 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | KDM1A | O60341 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7609859 | 0.91 | ALDH1A1 (0.76) | ALDH1A1HSD17B10TSHRTDP1HTT | |
| SCHEMBL655572 | 0.82 | ALDH1A1 (1.00) | ALDH1A1HSD17B10TSHRTDP1HTT | |
| SCHEMBL9480018 | 0.82 | ALDH1A1 (0.62) | ALDH1A1HSD17B10TSHRTDP1HTT | |
| SCHEMBL2035896 | 0.82 | ALDH1A1 (0.62) | ALDH1A1HSD17B10TSHRTDP1HTT | |
| SCHEMBL103850 | 0.82 | ALDH1A1 (1.00) | ALDH1A1HSD17B10TSHRTDP1CYP3A4 | |
| Toluene SCHEMBL28048088 | 0.81 | ALDH1A1 (0.73) | ALDH1A1HSD17B10TSHRTDP1HTT | |
| Hydrochloric Acid SCHEMBL716679 | 0.81 | ALDH1A1 (0.95) | ALDH1A1HSD17B10TSHRTDP1HTT | |
| SCHEMBL10866233 | 0.81 | ALDH1A1 (0.95) | ALDH1A1HSD17B10TSHRTDP1HTT | |
| Hydrochloric Acid SCHEMBL4208177 | 0.80 | ALDH1A1 (0.95) | ALDH1A1HSD17B10TSHRTDP1CYP3A4 | |
| Diphenylamine SCHEMBL11871615 | 0.80 | HSD17B10 (0.60) | ALDH1A1HSD17B10TSHRTDP1HTT |
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-6902663-B2 | C-nitrosoaniline compounds and their blends as polymerization inhibitors | UNIROYAL CHEMICAL COMPANY, INC. (US) | 2005-06-07 | — | — | US | disclosed |
| US-20040089586-A1 | C-nitrosoaniline compounds and their blends as polymerization inhibitors | UNIROYAL CHEMICAL COMPANY, INC. | 2004-05-13 | — | — | 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-20040089586-A1 | C-nitrosoaniline compounds and their blends as polymerization inhibitors | NOX5, ETFB, NOX1 | ALDH1A1 939/4885HSD17B10 1290/4885TSHR 4810/4885 |
“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.