SCHEMBL5328883

SCHEMBL5328883

COc1ccc(Cc2c(C)c3c(O)cc(C)cc3oc2=O)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 4/20 0.70
KDM4E B2RXH2 4/20 0.60
MAPT P10636 4/20 0.60
ALDH1A1 P00352 2/20 0.60
GAA P10253 2/20 0.60
CASP1 P29466 2/20 0.60
CASP7 P55210 2/20 0.60
HSD17B10 Q99714 2/20 0.60
NPSR1 Q6W5P4 1/20 0.60
VKORC1 Q9BQB6 1/20 0.54
ADORA3 P0DMS8 1/20 0.54
PTGDR2 Q9Y5Y4 1/20 0.53
CNR2 P34972 1/20 0.52
CDYL Q9Y232 1/20 0.51
ALOX5 P09917 1/20 0.50
SAE1 Q9UBE0 1/20 0.49
UBA2 Q9UBT2 1/20 0.49
NQO1 P15559 2/20 0.46
LMNA P02545 1/20 0.45
HPGD P15428 1/20 0.45

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
SCHEMBL5324274 0.87 KDM4E (0.60) RXFP1KDM4EMAPTALDH1A1GAA
SCHEMBL5331673 0.85 KDM4E (0.62) RXFP1KDM4EMAPTALDH1A1GAA
SCHEMBL5330767 0.85 KDM4E (0.62) RXFP1KDM4EMAPTALDH1A1GAA
SCHEMBL5330181 0.85 KDM4E (0.62) RXFP1KDM4EMAPTALDH1A1GAA
SCHEMBL5328894 0.85 KDM4E (0.81) RXFP1KDM4EMAPTALDH1A1GAA
SCHEMBL5328500 0.83 KDM4E (0.60) RXFP1KDM4EMAPTALDH1A1GAA
SCHEMBL5330769 0.83 KDM4E (0.60) RXFP1KDM4EMAPTALDH1A1GAA
SCHEMBL14346737 0.82 KDM4E (0.57) RXFP1KDM4EMAPTALDH1A1HSD17B10
SCHEMBL5325171 0.79 RXFP1 (0.69) RXFP1KDM4EMAPTALDH1A1GAA
SCHEMBL5328637 0.78 KDM4E (0.62) RXFP1KDM4EMAPTALDH1A1GAA

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
WO-2007144625-A1 2-OXO-2H-CHROMENE COMPOUNDS ARGENTA DISCOVERY LIMITED (GB) 2007-12-21 WO disclosed