SCHEMBL4352093

SCHEMBL4352093

C=CCc1ccc(OCOCOc2ccc(CC=C)cc2OC)c(OC)c1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.75
PPARA Q07869 3/20 0.75
PPARG P37231 1/20 0.75
PPARD Q03181 1/20 0.75
MAPT P10636 6/20 0.67
MEN1 O00255 5/20 0.67
KMT2A Q03164 5/20 0.67
SMN1; SMN2 Q16637 4/20 0.67
LMNA P02545 3/20 0.67
KDM4E B2RXH2 2/20 0.67
GAA P10253 2/20 0.67
HTT P42858 1/20 0.67
NPC1 O15118 4/20 0.61
RAB9A P51151 3/20 0.61
TP53 P04637 1/20 0.61
TSHR P16473 1/20 0.61
PTGS1 P23219 2/20 0.60
L3MBTL1 Q9Y468 2/20 0.60
CYP3A4 P08684 2/20 0.59
ALOX5 P09917 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL28798351 0.90 ALDH1A1 (0.75) ALDH1A1PPARAPPARGPPARDMAPT
SCHEMBL10536910 0.87 ALDH1A1 (0.80) ALDH1A1PPARAPPARGPPARDMAPT
Methyleugenol SCHEMBL28067388 0.86 ALDH1A1 (0.93) ALDH1A1PPARAPPARGPPARDMAPT
Methyleugenol SCHEMBL1869396 0.86 ALDH1A1 (1.00) ALDH1A1PPARAPPARGPPARDMAPT
Methyleugenol SCHEMBL113794 0.86 ALDH1A1 (1.00) ALDH1A1PPARAPPARGPPARDMAPT
Methyleugenol SCHEMBL29376951 0.86 ALDH1A1 (1.00) ALDH1A1PPARAPPARGPPARDMAPT
SCHEMBL9722038 0.85 ALDH1A1 (0.77) ALDH1A1PPARAPPARGPPARDMAPT
SCHEMBL9721996 0.85 ALDH1A1 (0.77) ALDH1A1PPARAPPARGPPARDMAPT
Allyleugenol SCHEMBL2779960 0.85 ALDH1A1 (0.77) ALDH1A1PPARAPPARGPPARDMAPT
Ethyleugenol SCHEMBL357018 0.85 ALDH1A1 (0.77) ALDH1A1PPARAPPARGPPARDMAPT

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108219185-A Methyl eugenol molecularly imprinted polymer and preparation method thereof 健士星生物技术研发(上海)有限公司 2018-06-29 CN disclosed
CN-108079972-A The method that methyl eugenol content in plants essential oil is removed using molecularly imprinted polymer 无限极(中国)有限公司 2018-05-29 CN disclosed
CN-107249545-A Composition providing delayed release of active substances 诺赛尔股份有限公司 2017-10-13 CN disclosed
CN-107107019-A It is coated microcapsules 宝洁公司 2017-08-29 CN disclosed
CN-106999895-A It is coated microcapsules 宝洁公司 2017-08-01 CN disclosed
CN-107001979-A Coated microcapsules 宝洁公司 2017-08-01 CN disclosed
CN-106999896-A Coated microcapsules 宝洁公司 2017-08-01 CN disclosed
CN-104090043-B A kind of method measuring methyl eugenol in cigarette mainstream flue gas CHINA TOBACCO JIANGSU INDUSTRIAL CO., LTD. (CN) 2015-12-30 CN disclosed
CN-103558319-B Method for measuring methyl eugenol in mainstream smoke of cigarettes CHINA TOBACCO JIANGSU IND CO 2015-06-10 CN disclosed
CN-104090043-A Method for measuring methyleugenol in cigarette mainstream smoke CHINA TOBACCO JIANGSU IND CO 2014-10-08 CN disclosed
CN-103558319-A Method for measuring methyl eugenol in mainstream smoke of cigarettes CHINA TOBACCO JIANGSU IND CO 2014-02-05 CN disclosed
US-8348098-B2 Dispensing device for dispensing a plurality of different preparations HENKEL AG & CO. KGAA (DE) 2013-01-08 US disclosed
CN-100565779-C Fluorescent lamp capable of slowly releasing organic evaporation material at low temperature KONINKL PHILIPS ELECTRONICS NV (NL) 2009-12-02 CN disclosed
US-20090277928-A1 DISPENSING DEVICE FOR DISPENSING A PLURALITY OF DIFFERENT PREPARATIONS HENKEL AG & CO. KGAA (DE) 2009-11-12 US disclosed
CN-101057312-A Fluorescent lamp capable of slow release of organic evaporating materials at low temperature KONINKL PHILIPS ELECTRONICS NV (NL) 2007-10-17 CN disclosed