Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.69 |
| ▸ | NQO2 | P16083 | 2/20 | 0.52 |
| ▸ | CYP1A1 | P04798 | 7/20 | 0.50 |
| ▸ | CYP1B1 | Q16678 | 7/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.44 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP4B1 | P13584 | 2/20 | 0.44 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.44 |
| ▸ | CYP3A5 | P20815 | 2/20 | 0.44 |
| ▸ | CYP2A7 | P20853 | 2/20 | 0.44 |
| ▸ | CYP3A7 | P24462 | 2/20 | 0.44 |
| ▸ | CYP2F1 | P24903 | 2/20 | 0.44 |
| ▸ | CYP2C18 | P33260 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL186502 | 0.94 | ALDH1A1 (0.59) | ALDH1A1NQO2CYP1A1CYP1B1TAAR1 | |
| SCHEMBL7234709 | 0.89 | ALDH1A1 (0.55) | ALDH1A1NQO2CYP1A1CYP1B1TAAR1 | |
| SCHEMBL4043764 | 0.85 | ALDH1A1 (0.50) | ALDH1A1NQO2CYP1A1CYP1B1TAAR1 | |
| SCHEMBL11885 | 0.84 | ALDH1A1 (0.48) | ALDH1A1NQO2CYP1A1CYP1B1TAAR1 | |
| SCHEMBL19862415 | 0.83 | ALDH1A1 (0.48) | ALDH1A1NQO2CYP1A1CYP1B1TAAR1 | |
| SCHEMBL12093569 | 0.83 | ALDH1A1 (0.48) | ALDH1A1NQO2CYP1A1CYP1B1TAAR1 | |
| SCHEMBL12093390 | 0.83 | ESR1 (0.50) | ALDH1A1NQO2CYP1A1CYP1B1TAAR1 | |
| 1,3,5-Trimethoxybenzene SCHEMBL28493 | 0.83 | ALDH1A1 (1.00) | ALDH1A1NQO2CYP1A1CYP1B1CYP1A2 | |
| SCHEMBL15936181 | 0.82 | ALDH1A1 (0.46) | ALDH1A1NQO2CYP1A1CYP1B1TAAR1 | |
| SCHEMBL12269194 | 0.82 | ALDH1A1 (0.46) | ALDH1A1NQO2CYP1A1CYP1B1TAAR1 |
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 1036 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113264837-B | Energetic ion salt of 3, 5-dihydroxy-2, 4, 6-trinitrobenzene derivative and preparation method thereof | 信阳师范学院 | 2023-09-29 | — | — | CN | claimed |
| CN-113264837-A | Energetic ionic salt of 3, 5-dihydroxy-2, 4, 6-trinitrobenzene derivative and preparation method thereof | 信阳师范学院 | 2021-08-17 | — | — | CN | claimed |
| CN-109516923-A | Compounds and organic luminescent device comprising it | 东进世美肯株式会社 | 2019-03-26 | — | — | CN | claimed |
| EP-1891180-B1 | ORGANIC SEMICONDUCTOR SOLUTIONS | MERCK PATENT GMBH (DE) | 2018-08-29 | — | — | EP | claimed |
| EP-1716604-B1 | SOLUTIONS OF ORGANIC SEMICONDUCTORS | MERCK PATENT GMBH (DE) | 2017-07-26 | — | — | EP | claimed |
| US-20160329510-A1 | PHOTOVOLTAIC CELLS | MERCK PATENT GMBH (DE) | 2016-11-10 | — | — | US | claimed |
| EP-3087156-A1 | PHOTOVOLTAIC CELLS | Merck Patent GmbH (DE) | 2016-11-02 | — | — | EP | claimed |
| CN-105849931-A | Photovoltaic cell | 默克专利有限公司 | 2016-08-10 | — | — | CN | claimed |
| EP-1745520-B1 | SOLUTIONS OF ORGANIC SEMICONDUCTORS | MERCK PATENT GMBH (DE) | 2015-10-21 | — | — | EP | claimed |
| WO-2015096886-A1 | PHOTOVOLTAIC CELLS | MERCK PATENT GMBH (DE) | 2015-07-02 | — | — | WO | claimed |
| EP-1716604-A1 | SOLUTIONS OF ORGANIC SEMICONDUCTORS | Merck Patent GmbH (DE) | 2006-11-02 | — | — | EP | claimed |
| EP-1370619-B1 | SOLUTIONS AND DISPERSIONS OF ORGANIC SEMICONDUCTORS | MERCK PATENT GMBH (DE) | 2006-06-21 | — | — | EP | claimed |
| US-20060127592-A1 | Solutions and dispersions of organic semiconductors | COVION ORGANIC SEMICONDUCTORS GMBH (DE) | 2006-06-15 | — | — | US | claimed |
| US-6994893-B2 | Dispersions of organic semiconductors in a solvent mixture of at least two different organic solvents, characterized in that each of the solvents on its own has a boiling point of below 200 degrees C. and a melting point of 15 degrees C. or less | COVION ORGANIC SEMICONDUCTORS GMBH (DE) | 2006-02-07 | — | — | US | claimed |
| WO-2005112145-A1 | SOLUTIONS OF ORGANIC SEMICONDUCTORS | MERCK PATENT GMBH (DE) | 2005-11-24 | — | — | WO | claimed |
| WO-2005083814-A1 | SOLUTIONS OF ORGANIC SEMICONDUCTORS | MERCK PATENT GMBH (DE) | 2005-09-09 | — | — | WO | claimed |
| US-20040225056-A1 | Solutions and dispersions of organic semiconductors | MERCK PATENT GMBH (DE) | 2004-11-11 | — | — | US | claimed |
| CN-1531579-A | Solutions and dispersions of organic semiconductors | �����л��뵼������˾ | 2004-09-22 | — | — | CN | claimed |
| EP-1370619-A1 | SOLUTIONS AND DISPERSIONS OF ORGANIC SEMICONDUCTORS | Covion Organic Semiconductors GmbH (DE) | 2003-12-17 | — | — | EP | claimed |
| WO-2002072714-A1 | SOLUTIONS AND DISPERSIONS OF ORGANIC SEMICONDUCTORS | COVION ORGANIC SEMICONDUCTORS GMBH (DE) | 2002-09-19 | — | — | WO | claimed |