SCHEMBL28366902

SCHEMBL28366902

CCc1cccc(OC(=O)C=CC=CC(=O)O)c1CC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
THRA P10827 1/20 0.38
THRB P10828 1/20 0.38
PPARA Q07869 2/20 0.37
PPARG P37231 1/20 0.37
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
HRH1 P35367 4/20 0.36
HTT P42858 2/20 0.35
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GABRA1 P14867 1/20 0.34
GABRB2 P47870 1/20 0.34
PTGER4 P35408 2/20 0.34
PTGER3 P43115 2/20 0.34
PTGER2 P43116 2/20 0.34
PTGER1 P34995 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
SCHEMBL28884791 0.91 KDM4E (0.46) KDM4EMAPTHPGDHSD17B10THRA
SCHEMBL20564932 0.88 MAPT (0.46) KDM4EMAPTHPGDHSD17B10THRA
SCHEMBL1836388 0.79 GABRA1 (0.42) KDM4EMAPTPPARAPPARGGABRA1
SCHEMBL28370997 0.79 MAPT (0.38) KDM4EMAPTHPGDHSD17B10THRA
SCHEMBL9177896 0.78 KDM4E (0.53) KDM4EMAPTHPGDHSD17B10THRA
SCHEMBL9177888 0.78 KDM4E (0.53) KDM4EMAPTHPGDHSD17B10THRA
SCHEMBL988680 0.77 GABRA1 (0.43) KDM4EMAPTHPGDHSD17B10THRA
SCHEMBL29580903 0.77 GABRA1 (0.43) KDM4EMAPTHPGDHSD17B10THRA
SCHEMBL20564033 0.75 KDM4E (0.49) KDM4EMAPTHPGDHSD17B10PPARG
SCHEMBL1840022 0.75 NCEH1 (0.39) KDM4EMAPTHPGDHSD17B10THRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110914334-A Polyester copolymer 阿凡田知识中心有限公司 2020-03-24 CN disclosed