Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.77 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | MGAM | O43451 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | SI | P14410 | 1/20 | 0.40 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | MMP12 | P39900 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Cyclohexane SCHEMBL2974039 | 1.00 | ALDH1A1 (0.77) | ALDH1A1TSHRMGAMGAASI | |
| Acetic Acid Methyl Ester SCHEMBL3650 | 0.88 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL28296965 | 0.88 | ALDH1A1 (1.00) | ALDH1A1TSHRMGAMGAASI | |
| Acetic Acid Methyl Ester SCHEMBL8322448 | 0.88 | ALDH1A1 (1.00) | ALDH1A1TSHRMGAMGAASI | |
| Acetic Acid Methyl Ester SCHEMBL3080739 | 0.88 | — | — | |
| Cyclohexane SCHEMBL29249835 | 0.87 | ALDH1A1 (0.59) | ALDH1A1TSHRMGAMGAASI | |
| Acetic Acid Methyl Ester SCHEMBL23092253 | 0.84 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL6749899 | 0.84 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL2992111 | 0.84 | ALDH1A1 (0.91) | ALDH1A1TSHRMGAMGAASI | |
| Acetic Acid Methyl Ester SCHEMBL21591845 | 0.84 | — | — |
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-20120077722-A1 | AMBERGRIS FRAGRANCE | SYMRISE AG (DE) | 2012-03-29 | — | — | 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-20120077722-A1 | AMBERGRIS FRAGRANCE | TRPA1, TAS2R31, TAS2R1 | ALDH1A1 769/4885TSHR 4168/4885MGAM 4367/4885 |
“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.