SCHEMBL819037

SCHEMBL819037

C=CC(=O)OCCOc1ccc(C2(c3ccc(OCCOC(=O)C=C)c(OCCOC(=O)C=C)c3)c3ccccc3-c3ccccc32)cc1OCCOC(=O)C=C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.49
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
ALDH1A1 P00352 5/20 0.36
TSHR P16473 4/20 0.36
TP53 P04637 2/20 0.36
HIF1A Q16665 2/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
POLB P06746 2/20 0.35
MAPT P10636 3/20 0.33
KDM4E B2RXH2 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
LMNA P02545 1/20 0.33
OPRK1 P41145 1/20 0.33
CASP6 P55212 1/20 0.33
CYP3A4 P08684 1/20 0.33
HSP90AA1 P07900 2/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL30390791 1.00 THRB (0.49) THRBESR1ESR2ALDH1A1TSHR
SCHEMBL29720691 0.90 THRB (0.46) THRBESR1ESR2ALDH1A1TSHR
SCHEMBL556299 0.90 THRB (0.46) THRBESR1ESR2ALDH1A1TSHR
SCHEMBL29720690 0.89 THRB (0.45) THRBESR1ESR2ALDH1A1TSHR
SCHEMBL557484 0.89 THRB (0.45) THRBESR1ESR2ALDH1A1TSHR
SCHEMBL2234000 0.89 THRB (0.48) THRBALDH1A1MEN1KMT2APOLB
SCHEMBL15356206 0.85 THRB (0.42) THRBESR1ESR2TSHRMEN1
SCHEMBL15356202 0.85 THRB (0.50) THRBESR1ESR2ALDH1A1TSHR
SCHEMBL14066386 0.84 ESR1 (0.38) ESR1ESR2TSHRMEN1KMT2A
SCHEMBL40434 0.84 THRB (0.63) THRBALDH1A1TSHRTP53HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180226605-A1 GAS BARRIER FILM, ORGANIC ELECTRONIC DEVICE, SUBSTRATE FOR ORGANIC ELECTROLUMINESCENCE DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2018-08-09 US disclosed
US-20180226605-A1 GAS BARRIER FILM, ORGANIC ELECTRONIC DEVICE, SUBSTRATE FOR ORGANIC ELECTROLUMINESCENCE DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2018-08-09 US disclosed
US-9540567-B2 Polymerizable liquid crystal composition and optically anisotropic body JNC CORPORATION (JP) 2017-01-10 US disclosed
US-9540567-B2 Polymerizable liquid crystal composition and optically anisotropic body JNC CORPORATION (JP) 2017-01-10 US disclosed
US-20160289562-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOSITION AND OPTICALLY ANISOTROPIC BODY JNC CORPORATION (JP) 2016-10-06 US disclosed
US-20160289562-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOSITION AND OPTICALLY ANISOTROPIC BODY JNC CORPORATION (JP) 2016-10-06 US disclosed
US-9315728-B2 Polymerizable liquid crystal composition and homogeneous-aligned liquid crystal film JNC CORPORATION (JP) 2016-04-19 US disclosed
US-9315728-B2 Polymerizable liquid crystal composition and homogeneous-aligned liquid crystal film JNC CORPORATION (JP) 2016-04-19 US disclosed
US-9080100-B2 Polymerizable liquid crystal composition JNC CORPORATION (JP) 2015-07-14 US disclosed
US-9080100-B2 Polymerizable liquid crystal composition JNC CORPORATION (JP) 2015-07-14 US disclosed
US-20100143612-A1 Polymerizable liquid crystal composition and homogeneous-aligned liquid crystal film CHISSO CORPORATION 2010-06-10 US disclosed
US-20100143612-A1 Polymerizable liquid crystal composition and homogeneous-aligned liquid crystal film CHISSO CORPORATION 2010-06-10 US disclosed
US-20100051866-A1 Polymerizable liquid crystal composition and optically anisotropic film using the same JNC PETROCHEMICAL CORPORATION (JP) 2010-03-04 US disclosed
US-20100051866-A1 Polymerizable liquid crystal composition and optically anisotropic film using the same JNC PETROCHEMICAL CORPORATION (JP) 2010-03-04 US disclosed
US-7476423-B2 Polymerizable liquid crystal composition CHISSO CORPORATION (JP) 2009-01-13 US disclosed
US-7476423-B2 Polymerizable liquid crystal composition CHISSO CORPORATION (JP) 2009-01-13 US disclosed
US-20080081133-A1 Trifunctional compound, composition and polymer thereof CHISSO CORPORATION 2008-04-03 US disclosed
US-20080081133-A1 Trifunctional compound, composition and polymer thereof CHISSO CORPORATION 2008-04-03 US disclosed
US-20080014374-A1 Polymerizable liquid crystal composition JNC PETROCHEMICAL CORPORATION (JP) 2008-01-17 US disclosed
US-20080014374-A1 Polymerizable liquid crystal composition JNC PETROCHEMICAL CORPORATION (JP) 2008-01-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080081133-A1 Trifunctional compound, composition and polymer thereof OXER1, AFF1, OXGR1 THRB 2863/4885ESR1 1699/4885ESR2 2191/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.