Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | TSHR | P16473 | 2/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.59 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | GMNN | O75496 | 1/20 | 0.59 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | TP53 | P04637 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.59 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | BLM | P54132 | 1/20 | 0.59 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | ATM | Q13315 | 1/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL113407 | 0.81 | ACHE (0.46) | ALDH1A1TSHRCYP2C9CYP2C19HIF1A | |
| SCHEMBL29402967 | 0.81 | ACHE (0.46) | ALDH1A1TSHRCYP2C9CYP2C19HIF1A | |
| SCHEMBL8955025 | 0.80 | ALDH1A1 (0.63) | ALDH1A1TSHRCYP2C9CYP2C19HIF1A | |
| SCHEMBL2958721 | 0.79 | CYP1A2 (0.47) | ALDH1A1TSHRCYP2C9CYP2C19HIF1A | |
| SCHEMBL5161078 | 0.79 | ALDH1A1 (0.38) | ALDH1A1TSHRCYP2C9CYP2C19HIF1A | |
| SCHEMBL11161013 | 0.77 | LMNA (0.54) | ALDH1A1TSHRCYP2C9CYP2C19HIF1A | |
| SCHEMBL2594091 | 0.77 | LMNA (0.42) | ALDH1A1TSHRCYP2C9CYP2C19HIF1A | |
| SCHEMBL9748660 | 0.76 | ALDH1A1 (0.36) | ALDH1A1TSHRCYP2C9CYP2C19HIF1A | |
| SCHEMBL9747633 | 0.75 | ALDH1A1 (0.39) | ALDH1A1TSHRCYP2C9CYP2C19HIF1A | |
| SCHEMBL2371710 | 0.74 | ALDH1A1 (1.00) | ALDH1A1TSHRCYP2C9CYP2C19HIF1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003089394-A2 | METHOD FOR THE PRODUCTION OF PHENYL PROPYL ALCOHOLS | SYMRISE GMBH & CO. KG (DE) | 2003-10-30 | — | — | WO | disclosed |
| EP-0217159-B1 | ALDEHYDES, ACETALS, ALCOHOLS AND ETHERS WITH 3-METHYL OR 3,5-DIMETHYLBENZYL GROUPS, THEIR PREPARATION AND THEIR USE AS FRAGRANCE COMPOUNDS | Consortium für elektrochemische Industrie GmbH (DE) | 1992-01-02 | — | — | EP | disclosed |
| US-4710316-A | Aldehydes, acetals, alcohols and ethers having 3-methyl- or 3,5-dimethyl-benzyl groups, their manufacture and perfume materials containing same | CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) | 1987-12-01 | — | — | US | disclosed |
| EP-0217159-A2 | Aldehydes, acetals, alcohols and ethers with 3-methyl or 3,5-dimethylbenzyl groups, their preparation and their use as fragrance compounds | Consortium für elektrochemische Industrie GmbH (DE) | 1987-04-08 | — | — | EP | disclosed |