Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.59 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.59 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | APLNR | P35414 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | PPP1CA | P62136 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL272391 | 1.00 | LMNA (0.59) | LMNANR1I2ABCB11ALDH1A1CYP3A4 | |
| SCHEMBL273324 | 1.00 | LMNA (0.59) | LMNANR1I2ABCB11ALDH1A1CYP3A4 | |
| Ciclactate SCHEMBL2111243 | 0.88 | LMNA (0.62) | LMNANR1I2ABCB11ALDH1A1CYP3A4 | |
| SCHEMBL26822918 | 0.85 | LMNA (0.42) | LMNANR1I2ABCB11ALDH1A1CYP3A4 | |
| SCHEMBL17639951 | 0.84 | LMNA (0.54) | LMNANR1I2ABCB11ALDH1A1CYP3A4 | |
| SCHEMBL19185119 | 0.82 | LMNA (0.56) | LMNANR1I2ABCB11ALDH1A1CYP3A4 | |
| SCHEMBL9594198 | 0.82 | LMNA (0.59) | LMNANR1I2ABCB11ALDH1A1CYP3A4 | |
| SCHEMBL11591288 | 0.82 | ALDH1A1 (0.56) | LMNANR1I2ABCB11ALDH1A1CYP3A4 | |
| SCHEMBL11591282 | 0.82 | ALDH1A1 (0.56) | LMNANR1I2ABCB11ALDH1A1CYP3A4 | |
| SCHEMBL10883498 | 0.82 | LMNA (0.52) | LMNANR1I2ABCB11ALDH1A1CYP3A4 |
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-8133856-B2 | Cis-3,3,5-trimethylcyclohexyl esters | SYMRISE AG (DE) | 2012-03-13 | — | — | US | claimed |
| EP-1648526-B1 | CIS-3,3,5-TRIMETHYLCYCLOHEXYL ESTERS | SYMRISE GMBH & CO KG (DE) | 2009-09-09 | — | — | EP | claimed |
| US-20060211597-A1 | Cis-3,3,5-trimethylcyclohexyl esters | SYMRISE AG (DE) | 2006-09-21 | — | — | US | claimed |
| US-8133856-B2 | Cis-3,3,5-trimethylcyclohexyl esters | SYMRISE AG (DE) | 2012-03-13 | — | — | US | disclosed |
| US-20060211597-A1 | Cis-3,3,5-trimethylcyclohexyl esters | SYMRISE AG (DE) | 2006-09-21 | — | — | US | disclosed |