Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | PPARG | P37231 | 1/20 | 0.57 |
| ▸ | PPARA | Q07869 | 1/20 | 0.57 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.56 |
| ▸ | LTA4H | P09960 | 1/20 | 0.55 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.54 |
| ▸ | CNR2 | P34972 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.53 |
| ▸ | LDHA | P00338 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | ACP3 | P15309 | 1/20 | 0.50 |
| ▸ | BACE1 | P56817 | 1/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL10687467 | 0.95 | ALDH1A1 (0.55) | ALDH1A1PPARGPPARASLC5A2LTA4H | |
| SCHEMBL11579350 | 0.93 | LDHA (0.58) | ALDH1A1PPARGPPARALTA4HCYP1A2 | |
| SCHEMBL5631116 | 0.84 | ALDH1A1 (0.57) | ALDH1A1SLC5A2LTA4HAOC3CNR2 | |
| SCHEMBL5355730 | 0.84 | ALDH1A1 (0.57) | ALDH1A1SLC5A2LTA4HAOC3CNR2 | |
| SCHEMBL28849551 | 0.84 | CALM1 (0.58) | LTA4HAOC3CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL9082119 | 0.83 | PPARG (0.56) | PPARGPPARALTA4HTSHR | |
| SCHEMBL7452361 | 0.83 | ALDH1A1 (0.56) | ALDH1A1SLC5A2AOC3CNR2TSHR | |
| SCHEMBL1428255 | 0.81 | LMNA (0.44) | ALDH1A1SLC5A2SLC6A4 | |
| SCHEMBL6715245 | 0.80 | KDM4E (0.60) | ALDH1A1AOC3CNR2KDM4EGAA | |
| SCHEMBL11792769 | 0.80 | GAA (0.52) | AOC3KDM4EGAASMN1; SMN2 |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109456161-B | Method for breaking carbon-carbon bond through visible light catalytic oxidation | 中国科学院大连化学物理研究所 | 2021-08-31 | — | — | CN | claimed |
| CN-109456161-A | A kind of method of visible light catalytic oxidation fracture carbon-carbon bond | 中国科学院大连化学物理研究所 | 2019-03-12 | — | — | CN | claimed |
| CN-109456160-A | A kind of method of photochemical catalytic oxidation fracture lignin model compound | 中国科学院大连化学物理研究所 | 2019-03-12 | — | — | CN | claimed |
| CN-109456161-B | Method for breaking carbon-carbon bond through visible light catalytic oxidation | 中国科学院大连化学物理研究所 | 2021-08-31 | — | — | CN | disclosed |
| CN-109456160-A | A kind of method of photochemical catalytic oxidation fracture lignin model compound | 中国科学院大连化学物理研究所 | 2019-03-12 | — | — | CN | disclosed |
| CN-109456161-A | A kind of method of visible light catalytic oxidation fracture carbon-carbon bond | 中国科学院大连化学物理研究所 | 2019-03-12 | — | — | CN | disclosed |
| US-6320085-B1 | REACTING BENZYL ALCOHOL DERIVATIVE WITH 1 TO 3 MOLAR EQUIVALENTS OF SPECIFIED ALCOHOL IN PRESENCE OF ACID, LEWIS ACID, METAL OXIDE OR METAL CARBONATE, ISOLATING RESULTING ETHER, STABILIZING BY ADDITION OF BASE AND/OR ANTIOXIDANT | AGRO-CHEMIE NOVENYVEDOSZER GYARTO ERTEKESITO EST FORGALMAZO KFT. (HU) | 2001-11-20 | — | — | US | disclosed |
| EP-0939749-B1 | PROCESS FOR THE PREPARATION OF BENZYL-ETHERS | AGRO CHEMIE NOEVENYVEDOESZER G (HU) | 2001-07-18 | — | — | EP | disclosed |
| US-6133403-A | RESOLE MIXTURE INCLUDING A SUBSTITUTED BENZYL ALCOHOL OR ETHER, ACID CURING CATALYST; IMPACT STRENGTH, FLEXIBILITY | BORDEN CHEMICAL, INC. (US) | 2000-10-17 | — | — | US | disclosed |
| EP-0939749-A1 | PROCESS FOR THE PREPARATION OF BENZYL-ETHERS | Agro-Chemie Növenyvedöszer Gyárto Ertékesito Es Forgalmazo KFT. (HU) | 1999-09-08 | — | — | EP | disclosed |
| WO-1998022416-A1 | PROCESS FOR THE PREPARATION OF BENZYL-ETHERS | AGRO-CHEMIE NÖVÉNYVÉDÖSZER GYÁRTÓ ÉRTÉKESITÓ ÉS FORGALMAZÓ KFT. (HU) | 1998-05-28 | — | — | WO | disclosed |
| US-4079075-A | Primary alkyl esters as mediums for oxidations by phase-transfer catalyzed hypohalites | THE DOW CHEMICAL COMPANY (US) | 1978-03-14 | — | — | US | disclosed |