SCHEMBL690895

SCHEMBL690895

CC(O)C(O)CCc1ccc(O)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.52
ESR2 Q92731 1/20 0.52
ADRB2 P07550 5/20 0.51
OPRK1 P41145 3/20 0.49
KDM4E B2RXH2 3/20 0.47
CA2 P00918 2/20 0.46
SLC6A2 P23975 5/20 0.46
ADRB1 P08588 3/20 0.46
LMNA P02545 3/20 0.46
SLC6A4 P31645 3/20 0.46
OPRM1 P35372 3/20 0.46
CYP2D6 P10635 2/20 0.46
HIF1A Q16665 2/20 0.46
ADRA1A P35348 2/20 0.46
SLC6A3 Q01959 2/20 0.46
GALR3 O60755 1/20 0.46
TAAR1 Q96RJ0 3/20 0.45
SIGMAR1 Q99720 3/20 0.45
ADRB3 P13945 2/20 0.45
TMEM97 Q5BJF2 2/20 0.45

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
SCHEMBL108731 0.88 ESR1 (0.52) ESR1ESR2ADRB2OPRK1KDM4E
SCHEMBL1681740 0.83 CYP1A2 (0.45) ADRB2TAAR1KCNH2CYP1A2ALDH1A1
SCHEMBL13698055 0.83 ESR1 (0.56) ESR1ESR2ADRB2OPRK1KDM4E
SCHEMBL105870 0.83 ESR1 (0.56) ESR1ESR2ADRB2OPRK1KDM4E
SCHEMBL13698052 0.83 ESR1 (0.56) ESR1ESR2ADRB2OPRK1KDM4E
SCHEMBL107431 0.82 ADRB2 (0.47) ESR1ESR2ADRB2OPRK1KDM4E
SCHEMBL105518 0.81 TSHR (0.50) ADRB2OPRK1KDM4ESLC6A2ADRB1
SCHEMBL104626 0.80 ESR1 (0.59) ESR1ESR2ADRB2OPRK1KDM4E
SCHEMBL107844 0.78 TAAR1 (0.59) ESR1ESR2ADRB2SLC6A2ADRB1
SCHEMBL7270279 0.78 ESR1 (0.62) ESR1ESR2ADRB2OPRK1KDM4E

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3519567-A1 ENGINEERED MICROORGANISMS FOR PRODUCTION OF COMMODITY CHEMICALS AND CELLULAR BIOMASS The Regents of The University of California (US) 2019-08-07 EP disclosed
WO-2018151833-A1 HIGH PRESSURE ZONE FORMATION FOR PRETREATMENT SWEETWATER ENERGY, INC. (US) 2018-08-23 WO disclosed
WO-2018067458-A1 ENGINEERED MICROORGANISMS FOR PRODUCTION OF COMMODITY CHEMICALS AND CELLULAR BIOMASS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-04-12 WO disclosed
EP-3230463-A1 RAPID PRETREATMENT Sweetwater Energy, Inc. (US) 2017-10-18 EP disclosed
WO-2016094594-A1 RAPID PRETREATMENT SWEETWATER ENERGY, INC. (US) 2016-06-16 WO disclosed
WO-2015179243-A1 SUGAR SEPARATION AND PURIFICATION THROUGH FILTRATION SWEETWATER ENERGY, INC. (US) 2015-11-26 WO disclosed
EP-2812437-A1 ENHANCING FERMENTATION OF STARCH-AND SUGAR-BASED FEEDSTOCKS Sweetwater Energy, Inc. (US) 2014-12-17 EP disclosed
WO-2014190294-A1 SUGAR SEPARATION AND PURIFICATION FROM BIOMASS SWEETWATER ENERGY, INC. (US) 2014-11-27 WO disclosed
WO-2013120035-A1 ENHANCING FERMENTATION OF STARCH-AND SUGAR-BASED FEEDSTOCKS SWEETWATER ENERGY, INC. (US) 2013-08-15 WO disclosed
WO-2013115959-A1 METHODS AND COMPOSITIONS FOR GROWTH OF YEAST ON ALGINATE BIO ARCHITECTURE LAB, INC. (US) 2013-08-08 WO disclosed
WO-2011081658-A2 METHODS AND COMPOSITIONS FOR PRODUCING CHEMICAL PRODUCTS FROM C. PHYTOFERMENTANTS QTEROS, INC. (US) 2011-07-07 WO disclosed
WO-2010123932-A9 COMPOSITIONS AND METHODS FOR FERMENTATION OF BIOMASS QTEROS, INC. (US) 2011-06-09 WO disclosed
WO-2011002824-A1 PRETREATMENT OF BIOMASS QTEROS, INC. (US) 2011-01-06 WO disclosed
EP-2245162-A2 ISOLATED ALCOHOL DEHYDROGENASE ENZYMES AND USES THEREOF Bio Architecture Lab, Inc. (US) 2010-11-03 EP disclosed
WO-2010124147-A1 COMPOSITIONS AND METHODS FOR METHANE PRODUCTION QTEROS, INC. (US) 2010-10-28 WO disclosed
WO-2010123932-A1 COMPOSITIONS AND METHODS FOR FERMENTATION OF BIOMASS QTEROS, INC. (US) 2010-10-28 WO disclosed
EP-2195440-A2 BIOFUEL PRODUCTION Bio Architecture Lab, Inc. (US) 2010-06-16 EP disclosed
WO-2009097346-A2 ISOLATED ALCOHOL DEHYDROGENASE ENZYMES AND USES THEREOF BIO ARCHITECTURE LAB, INC. (US) 2009-08-06 WO disclosed
WO-2009046370-A2 BIOFUEL PRODUCTION BIO ARCHITECTURE LAB, INC. (US) 2009-04-09 WO disclosed
WO-2009046375-A2 BIOFUEL PRODUCTION BIO ARCHITECTURE LAB, INC. (US) 2009-04-09 WO disclosed