Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | PPM1B | O75688 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | PPP1CC | P36873 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | TLR4 | O00206 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL15800134 | 1.00 | ALDH1A1 (0.34) | ALDH1A1PPM1BPTPN1PPP1CCCA12 | |
| SCHEMBL7733838 | 0.87 | ALDH1A1 (0.41) | ALDH1A1PPM1BPTPN1PPP1CCTLR4 | |
| SCHEMBL3003560 | 0.87 | ALDH1A1 (0.41) | ALDH1A1PPM1BPTPN1PPP1CCTLR4 | |
| SCHEMBL31017143 | 0.87 | ALDH1A1 (0.37) | ALDH1A1PPM1BPTPN1PPP1CCCA12 | |
| SCHEMBL417314 | 0.87 | ALDH1A1 (0.37) | ALDH1A1PPM1BPTPN1PPP1CCCA12 | |
| SCHEMBL14870941 | 0.85 | ALDH1A1 (0.43) | ALDH1A1PPM1BPTPN1PPP1CCMAPT | |
| SCHEMBL15800125 | 0.80 | ALDH1A1 (0.36) | ALDH1A1PPM1BPTPN1PPP1CCCA12 | |
| SCHEMBL594647 | 0.77 | TP53 (0.48) | ALDH1A1PPM1BPTPN1PPP1CCTLR4 | |
| SCHEMBL594645 | 0.77 | TP53 (0.48) | ALDH1A1PPM1BPTPN1PPP1CCTLR4 | |
| SCHEMBL6899600 | 0.77 | TP53 (0.48) | ALDH1A1PPM1BPTPN1PPP1CCTLR4 |
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-20130096338-A1 | ASYMMETRIC CYCLIZATION PROCESSES USING UNSATURATED NITRO COMPOUNDS | NANYANG TECHNOLOGICAL UNIVERSITY (SG) | 2013-04-18 | — | — | 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-20130096338-A1 | ASYMMETRIC CYCLIZATION PROCESSES USING UNSATURATED NITRO COMPOUNDS | NQO1, COASY, NOS2 | ALDH1A1 2383/4885PPM1B 4181/4885PTPN1 4454/4885 |
“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.