Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOAT1 | P35610 | 5/20 | 0.31 |
| ▸ | SOAT2 | O75908 | 4/20 | 0.31 |
| ▸ | ACE | P12821 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL14600828 | 1.00 | SOAT1 (0.31) | SOAT1SOAT2ACECA1CA9 | |
| SCHEMBL14716859 | 0.85 | SOAT1 (0.32) | SOAT1SOAT2 | |
| SCHEMBL19222062 | 0.82 | POLB (0.40) | ACE | |
| SCHEMBL13355731 | 0.79 | — | — | |
| SCHEMBL17822599 | 0.78 | TLR7 (0.36) | — | |
| SCHEMBL20021671 | 0.78 | ACE (0.31) | ACE | |
| SCHEMBL20021672 | 0.78 | ACE (0.31) | ACE | |
| SCHEMBL17904276 | 0.75 | TLR7 (0.32) | — | |
| SCHEMBL17972369 | 0.72 | — | — | |
| SCHEMBL16563037 | 0.72 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6833475-B2 | Using 4-oxo-2,6-dimethyl-hepanoic acid; lactonization; coconut flavor for alcoholic beverage | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2004-12-21 | — | — | US | disclosed |
| US-20030212281-A1 | Heptanonic acid and furanone compounds and compositions | COUNCIL OF SCIENTIFIC & INDUSTIRAL RESEARCH | 2003-11-13 | — | — | US | disclosed |
| US-6579992-B2 | Use for flavouring a wide range of food stuffs including baked goods, beverages, and confectionery | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2003-06-17 | — | — | US | disclosed |
| WO-2002079180-A1 | A METHOD FOR CONVERTING DIHYDROTAGETONE, A BIFUNCTIONAL ACYCLIC MONOTERPENE KETONE INTO 5-ISOBUTYL-3-METHYL-4,5-DIHYDRO-2(3H)-FURANONE AS A ANALOGUE OF NATURAL WHISKY LACTONE AND COCONUT ALDEHYDE | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2002-10-10 | — | — | WO | disclosed |
| US-20020137949-A1 | Novel method for converting dihydrotagetone, a bifuctional acyclic monoterpene ketone, isolated from the plant species of tagetes, into a coconut flavoured two chiral centered compound 5-isobutyl-3-methyl-4,5-dihydro-2(3H)-furanone as a novel analogue of natural whisky lactone and coconut aldehyde | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2002-09-26 | — | — | 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 (2 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-20020137949-A1 | Novel method for converting dihydrotagetone, a bifuctional acyclic monoterpene ketone, isolated from the plant species of tagetes, into a coconut flavoured two chiral centered compound 5-isobutyl-3-methyl-4,5-dihydro-2(3H)-furanone as a novel analogue of natural whisky lactone and coconut aldehyde | ADH1C, ADH5, ME1 | SOAT1 898/4885SOAT2 588/4885ACE 2975/4885 |
| US-20030212281-A1 | Heptanonic acid and furanone compounds and compositions | ADH1C, ME1, ADH1A | SOAT1 1500/4885SOAT2 1414/4885ACE 3159/4885 |
“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.