Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.43 |
| ▸ | ENTPD5 | O75356 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.41 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.39 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8410405 | 1.00 | ALDH1A1 (0.54) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL13455228 | 1.00 | ALDH1A1 (0.54) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL13455159 | 1.00 | ALDH1A1 (0.54) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL480931 | 1.00 | ALDH1A1 (0.54) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL18129448 | 1.00 | ALDH1A1 (0.54) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL19924587 | 1.00 | ALDH1A1 (0.54) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL9201747 | 1.00 | ALDH1A1 (0.54) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL15315231 | 1.00 | ALDH1A1 (0.54) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL20672681 | 1.00 | ALDH1A1 (0.54) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL14563524 | 1.00 | ALDH1A1 (0.54) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0403945-B1 | Cycloaliphatic carbinols and their use as starting materials for the preparation of furan derivatives | FIRMENICH & CIE (CH) | 1996-12-18 | — | — | EP | claimed |
| EP-0585828-B1 | Preparation of 6-(2,6,6-trimethyl-cyclohex-1-en-tyl)-4-methyl-hex-3-enol and -4-enol | GIVAUDAN ROURE INT (CH) | 1995-11-02 | — | — | EP | claimed |
| EP-0525579-B1 | Process for preparing substituted hexemic acids | GIVAUDAN ROURE INT (CH) | 1995-09-20 | — | — | EP | claimed |
| US-5329053-A | Process for the manufacture of known odorants | GIVAUDAN-ROURE CORPORATION (US) | 1994-07-12 | — | — | US | claimed |
| EP-0585828-A1 | Preparation of 6-(2,6,6-trimethyl-cyclohex-1-en-tyl)-4-methyl-hex-3-enol and -4-enol | GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) | 1994-03-09 | — | — | EP | claimed |
| EP-0585828-B1 | Preparation of 6-(2,6,6-trimethyl-cyclohex-1-en-tyl)-4-methyl-hex-3-enol and -4-enol | GIVAUDAN ROURE INT (CH) | 1995-11-02 | — | — | EP | disclosed |
| EP-0525579-B1 | Process for preparing substituted hexemic acids | GIVAUDAN ROURE INT (CH) | 1995-09-20 | — | — | EP | disclosed |
| US-5329053-A | Process for the manufacture of known odorants | GIVAUDAN-ROURE CORPORATION (US) | 1994-07-12 | — | — | US | disclosed |
| US-5329053-A | Process for the manufacture of known odorants | GIVAUDAN-ROURE CORPORATION (US) | 1994-07-12 | — | — | US | disclosed |
| EP-0585828-A1 | Preparation of 6-(2,6,6-trimethyl-cyclohex-1-en-tyl)-4-methyl-hex-3-enol and -4-enol | GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) | 1994-03-09 | — | — | EP | disclosed |
| EP-0585828-A1 | Preparation of 6-(2,6,6-trimethyl-cyclohex-1-en-tyl)-4-methyl-hex-3-enol and -4-enol | GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) | 1994-03-09 | — | — | EP | disclosed |
| US-5292902-A | Process for the manufacture of odorants and intermediates used therein | GIVAUDAN-ROURE CORPORATION (US) | 1994-03-08 | — | — | US | disclosed |
| EP-0525579-A2 | Process for preparing substituted hexemic acids | GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) | 1993-02-03 | — | — | EP | disclosed |
| US-5155238-A | Acidic cyclization of polyunsaturated, acyclic alcohol or protected alcohol; stereospecific; organoleptic | FIRMENICH S.A. (CH) | 1992-10-13 | — | — | US | disclosed |