Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL1644081 | 0.77 | MEN1 (0.41) | ALDH1A1TSHRTDP1 | |
| SCHEMBL1647033 | 0.77 | ALDH1A1 (0.33) | ALDH1A1TSHRTDP1 | |
| SCHEMBL1645821 | 0.77 | ALDH1A1 (0.45) | ALDH1A1TSHRTDP1 | |
| SCHEMBL1645873 | 0.75 | ALDH1A1 (0.32) | ALDH1A1TSHRTDP1 | |
| SCHEMBL10536539 | 0.74 | TSHR (0.30) | TSHR | |
| SCHEMBL10536545 | 0.74 | TSHR (0.30) | TSHR | |
| SCHEMBL7989990 | 0.73 | ALDH1A1 (0.38) | ALDH1A1TSHRTDP1 | |
| SCHEMBL11132928 | 0.72 | ALDH1A1 (0.41) | ALDH1A1TSHRTDP1 | |
| SCHEMBL14563926 | 0.71 | — | — | |
| SCHEMBL5468458 | 0.71 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9756872-B2 | Substituted butanol derivatives and their use as fragrance and flavor materials | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2017-09-12 | — | — | US | disclosed |
| US-20150245641-A1 | SUBSTITUTED BUTANOL DERIVATIVES AND THEIR USE AS FRAGRANCE AND FLAVOR MATERIALS | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2015-09-03 | — | — | US | disclosed |
| EP-2307429-A1 | SUBSTITUTED BUTANOL DERIVATIVES AND THEIR USE AS FRAGRANCE AND FLAVOR MATERIALS | Takasago International Corporation (JP) | 2011-04-13 | — | — | EP | disclosed |
| WO-2010002386-A1 | SUBSTITUTED BUTANOL DERIVATIVES AND THEIR USE AS FRAGRANCE AND FLAVOR MATERIALS | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2010-01-07 | — | — | WO | 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-20150245641-A1 | SUBSTITUTED BUTANOL DERIVATIVES AND THEIR USE AS FRAGRANCE AND FLAVOR MATERIALS | ACMSD, C1S, C5 | ALDH1A1 1081/4885TSHR 3468/4885TDP1 4134/4885 |
“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.