SCHEMBL1024184

SCHEMBL1024184

C=C(C)C(=O)OCCOC(=O)CC(C)=O.[Zr]

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.55
TSHR P16473 3/20 0.48
ALDH1A1 P00352 2/20 0.43
MGAM O43451 2/20 0.43
GAA P10253 2/20 0.43
SI P14410 2/20 0.43
MGAM2 Q2M2H8 2/20 0.43
POLB P06746 1/20 0.41
APEX1 P27695 1/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
MAPT P10636 1/20 0.32
BLM P54132 1/20 0.32
CHRM5 P08912 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
DGKA P23743 1/20 0.31
FAAH O00519 1/20 0.30

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
SCHEMBL15263096 0.98 THRB (0.57) THRBTSHRALDH1A1MGAMGAA
SCHEMBL62134 0.98 THRB (0.57) THRBTSHRALDH1A1MGAMGAA
SCHEMBL15551481 0.96 THRB (0.55) THRBTSHRALDH1A1MGAMGAA
Bromide SCHEMBL31560051 0.96 THRB (0.55) THRBTSHRALDH1A1MGAMGAA
SCHEMBL31310662 0.96 THRB (0.55) THRBTSHRALDH1A1MGAMGAA
SCHEMBL5969505 0.96 THRB (0.55) THRBTSHRALDH1A1MGAMGAA
SCHEMBL11658746 0.96 THRB (0.55) THRBTSHRALDH1A1MGAMGAA
SCHEMBL27924165 0.96 THRB (0.55) THRBTSHRALDH1A1MGAMGAA
Methacrylic Acid SCHEMBL25423390 0.92 THRB (0.52) THRBTSHRALDH1A1MGAMGAA
SCHEMBL12394966 0.92 THRB (0.61) THRBTSHRALDH1A1MGAMGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109070050-A The porous surface material of the core comprising coating for chromatographic isolation with narrow particle size distribution, preparation method, with and application thereof 沃特世科技公司 2018-12-21 CN disclosed
CN-103154817-B Direct description type waterless lithographic plate TORAY INDUSTRIES, INC. (JP) 2015-11-25 CN disclosed
US-20110056556-A1 DYE-SENSITIZED SOLAR CELL AND METHOD FOR MANUFACTURING THE SAME KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2011-03-10 US disclosed
EP-2276104-A1 DYE-SENSITIZED SOLAR CELL AND METHOD FOR MANUFACTURING THE SAME Konica Minolta Business Technologies, Inc. (JP) 2011-01-19 EP disclosed