Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.30 |
| ▸ | CHRNB4 | P30926 | 4/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 4/20 | 0.30 |
| ▸ | CHRNA7 | P36544 | 4/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.30 |
| ▸ | CHRNA1 | P02708 | 3/20 | 0.30 |
| ▸ | CHRNG | P07510 | 3/20 | 0.30 |
| ▸ | CHRNB1 | P11230 | 3/20 | 0.30 |
| ▸ | CHRND | Q07001 | 3/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| SCHEMBL6899186 | 1.00 | ALDH1A1 (0.37) | ALDH1A1NPSR1TSHRKDM4EHTT | |
| SCHEMBL14721823 | 1.00 | ALDH1A1 (0.37) | ALDH1A1NPSR1TSHRKDM4EHTT | |
| SCHEMBL24477676 | 1.00 | ALDH1A1 (0.37) | ALDH1A1NPSR1TSHRKDM4EHTT | |
| SCHEMBL10582187 | 0.78 | — | — | |
| Methyl Alcohol SCHEMBL4652953 | 0.73 | ALDH1A1 (0.36) | ALDH1A1NPSR1 | |
| SCHEMBL215249 | 0.72 | ALDH1A1 (0.34) | ALDH1A1NPSR1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL1496206 | 0.72 | ALDH1A1 (0.34) | ALDH1A1NPSR1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL7428255 | 0.70 | ALDH1A1 (0.37) | ALDH1A1NPSR1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL14393370 | 0.70 | ALDH1A1 (0.37) | ALDH1A1NPSR1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL24586087 | 0.70 | ALDH1A1 (0.37) | ALDH1A1NPSR1CHRNB2CHRNB4CHRNA3 |
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-20080249077-A1 | 17.Beta.-Fluoromethoxycarbonyl-Androst-4-En-3-One Compounds With a 17.Alpha.-Carbonate Sustituent | GLAXO GROUP LIMITED (GB) | 2008-10-09 | — | — | 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-20080249077-A1 | 17.Beta.-Fluoromethoxycarbonyl-Androst-4-En-3-One Compounds With a 17.Alpha.-Carbonate Sustituent | HSD17B7, CYP17A1, HSD3B1 | ALDH1A1 435/4885NPSR1 876/4885TSHR 1005/4885 |
“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.