Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 3/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | CDC25A | P30304 | 6/20 | 0.31 |
| ▸ | CDC25B | P30305 | 6/20 | 0.31 |
| ▸ | CDC25C | P30307 | 5/20 | 0.31 |
| ▸ | THRA | P10827 | 2/20 | 0.31 |
| ▸ | SCD | O00767 | 1/20 | 0.31 |
| ▸ | NAAA | Q02083 | 1/20 | 0.30 |
| ▸ | DGKA | P23743 | 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 | |
|---|---|---|---|---|
| SCHEMBL7175309 | 0.86 | ALDH1A1 (0.38) | TSHRTDP1ALDH1A1LMNAPOLB | |
| SCHEMBL2142693 | 0.81 | ALDH1A1 (0.38) | TDP1ALDH1A1LMNAPOLBRECQL | |
| SCHEMBL4237197 | 0.76 | ALDH1A1 (0.46) | TSHRTDP1ALDH1A1LMNAPOLB | |
| Acetic Acid SCHEMBL9004888 | 0.76 | ALDH1A1 (0.42) | TDP1ALDH1A1LMNAPOLBRECQL | |
| SCHEMBL8429054 | 0.76 | ALOX5 (0.44) | TSHRTDP1ALDH1A1LMNAHSD17B10 | |
| Lithium Ion SCHEMBL8677043 | 0.74 | GPR84 (0.46) | TDP1ALDH1A1LMNAPOLBRECQL | |
| SCHEMBL7187409 | 0.72 | SCD (0.40) | TDP1ALDH1A1LMNAPOLBRECQL | |
| SCHEMBL4297676 | 0.71 | ALDH1A1 (0.40) | TDP1ALDH1A1LMNAPOLBRECQL | |
| SCHEMBL4441878 | 0.70 | ALDH1A1 (0.39) | TDP1ALDH1A1LMNAPOLBRECQL | |
| SCHEMBL11765129 | 0.69 | SCD (0.45) | TDP1ALDH1A1LMNAPOLBRECQL |
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-6586620-B1 | Isomerisation of methyl 3-acetoxy-2,3-epoxy-2-pentyl-1-cyclopentaneacetate to give jasmonic acid, methyl ester used in perfumes | FIRMENICH SA (CH) | 2003-07-01 | — | — | US | disclosed |
| US-6586620-B1 | Isomerisation of methyl 3-acetoxy-2,3-epoxy-2-pentyl-1-cyclopentaneacetate to give jasmonic acid, methyl ester used in perfumes | FIRMENICH SA (CH) | 2003-07-01 | — | — | US | disclosed |
| EP-0583564-B1 | Process for the preparation of 3-oxo-2-pentyl-1-cyclopentene alkyl acetates | FIRMENICH & CIE (CH) | 1996-10-09 | — | — | EP | disclosed |
| EP-0583564-A1 | Process for the preparation of 3-oxo-2-pentyl-1-cyclopentene alkyl acetates | FIRMENICH SA (CH) | 1994-02-23 | — | — | EP | disclosed |