SCHEMBL1024182

SCHEMBL1024182

C=C(C)C(=O)OCCC(C(C)=O)C(=O)[O-].C=C(C)C(=O)OCCC(C(C)=O)C(=O)[O-].C=C(C)C(=O)OCCC(C(C)=O)C(=O)[O-].C=C(C)C(=O)OCCC(C(C)=O)C(=O)[O-].[Zr+4]

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.44
TSHR P16473 3/20 0.43
ALDH1A1 P00352 2/20 0.35
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL15655550 0.97 THRB (0.44) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL1436452 0.97 THRB (0.44) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL14802062 0.97 THRB (0.44) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL14802105 0.97 THRB (0.44) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL14802014 0.97 THRB (0.44) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL6762329 0.95 TSHR (0.43) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL5153189 0.95 THRB (0.47) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL14802069 0.95 THRB (0.43) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL136327 0.92 TSHR (0.45) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL136838 0.92 TSHR (0.43) THRBTSHRALDH1A1POLBAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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