SCHEMBL176065

SCHEMBL176065

CC(=O)C(O)C(c1ccccc1)c1ccc(O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.44
HSD17B10 Q99714 1/20 0.44
ESR1 P03372 3/20 0.43
ESR2 Q92731 3/20 0.43
GAA P10253 2/20 0.42
ALDH1A1 P00352 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HPGD P15428 1/20 0.42
IDO1 P14902 1/20 0.42
TDO2 P48775 1/20 0.42
MAPK1 P28482 1/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
NPY5R Q15761 1/20 0.40
CES2 O00748 1/20 0.39
BRD4 O60885 1/20 0.39
PDCD1 Q15116 1/20 0.39
CD274 Q9NZQ7 1/20 0.39
GMNN O75496 1/20 0.39

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
SCHEMBL108057 0.92 ESR1 (0.48) LMNAESR1ESR2ALDH1A1KMT2A
SCHEMBL107151 0.90 HPGD (0.48) LMNAALDH1A1KMT2AHPGDMAPK1
SCHEMBL3691019 0.84 BRD4 (0.59) LMNAGAAKMT2ATDP1HPGD
SCHEMBL3689613 0.81 ACP3 (0.54) LMNAHSD17B10GAAALDH1A1KMT2A
SCHEMBL6754777 0.79 CNR1 (0.51) LMNAHSD17B10ESR1ESR2GAA
SCHEMBL17995329 0.77 IDO1 (0.56) LMNAHSD17B10ESR1ESR2GAA
SCHEMBL14163315 0.77 IDO1 (0.56) LMNAHSD17B10ESR1ESR2GAA
SCHEMBL503028 0.77 IDO1 (0.56) LMNAHSD17B10ESR1ESR2GAA
SCHEMBL5700715 0.76 ESR1 (0.50) LMNAHSD17B10ESR1ESR2ALDH1A1
SCHEMBL23817107 0.74 ESR1 (0.52) LMNAHSD17B10ESR1ESR2GAA

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.

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-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-2013115959-A1 METHODS AND COMPOSITIONS FOR GROWTH OF YEAST ON ALGINATE BIO ARCHITECTURE LAB, INC. (US) 2013-08-08 WO disclosed
WO-2012103385-A2 BIOCATALYSTS SYNTHESIZING DEREGULATED CELLULASES QTEROS, INC. (US) 2012-08-02 WO disclosed
EP-2424982-A1 ADAPTING MICROORGANISMS FOR AGRICULTURAL PRODUCTS De Crecy, Eudes (US) 2012-03-07 EP disclosed
WO-2011149956-A2 METHODS FOR PRODUCING CHEMICAL PRODUCTS FROM FERMENTATION BYPRODUCTS QTEROS, INC. (US) 2011-12-01 WO disclosed
WO-2011106576-A2 METHODS AND COMPOSITIONS FOR ENHANCED ENZYME ACTIVITY IN FERMENTING MICROORGANISMS QTEROS, INC. (US) 2011-09-01 WO disclosed
WO-2010127182-A1 ADAPTING MICROORGANISMS FOR AGRICULTURAL PRODUCTS EVOLUGATE, LLC (US) 2010-11-04 WO disclosed
EP-2227449-A1 NOVEL BETA-HYDROXYKETONES AND BETA-ALKOXYKETONES WITH ESTROGENIC ACTIVITY Pulkkinen, Juha (FI) 2010-09-15 EP disclosed
WO-2009066008-A1 NOVEL BETA-HYDROXYKETONES AND BETA-ALKOXYKETONES WITH ESTROGENIC ACTIVITY PULKKINEN JUHA (FI) 2009-05-28 WO disclosed