SCHEMBL28457641

SCHEMBL28457641

Cc1ccc2oc(-c3ccc(C)c(C)c3)c(O)c(=O)c2c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.71
TP53 P04637 7/20 0.71
CSNK2A2 P19784 6/20 0.71
CSNK2B P67870 6/20 0.71
CSNK2A1 P68400 6/20 0.71
KDM4E B2RXH2 6/20 0.71
MEN1 O00255 5/20 0.69
KMT2A Q03164 5/20 0.69
CYP3A4 P08684 4/20 0.69
ALDH1A1 P00352 3/20 0.69
CASP1 P29466 2/20 0.69
CASP7 P55210 2/20 0.69
RXFP1 Q9HBX9 2/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
POLB P06746 1/20 0.62
ALOX12 P18054 2/20 0.58
HTT P42858 2/20 0.58
LMNA P02545 2/20 0.58
RET P07949 1/20 0.58
TSHR P16473 1/20 0.58

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
SCHEMBL7659883 0.86 MAPT (0.71) MAPTTP53CSNK2A2CSNK2BCSNK2A1
SCHEMBL7457890 0.84 TP53 (0.72) MAPTTP53KDM4EMEN1KMT2A
SCHEMBL25209431 0.84 MAPT (0.57) MAPTTP53CSNK2A2CSNK2BCSNK2A1
SCHEMBL4650064 0.83 MAPT (1.00) MAPTTP53CSNK2A2CSNK2BCSNK2A1
SCHEMBL6770344 0.83 MAPT (0.67) MAPTTP53CSNK2A2CSNK2BCSNK2A1
SCHEMBL5138212 0.82 MAPT (1.00) MAPTTP53CSNK2A2CSNK2BCSNK2A1
SCHEMBL30667444 0.82 MAPT (1.00) MAPTTP53CSNK2A2CSNK2BCSNK2A1
SCHEMBL4648920 0.81 CSNK2A2 (1.00) MAPTTP53CSNK2A2CSNK2BCSNK2A1
SCHEMBL17353581 0.81 MAPT (0.72) MAPTTP53CSNK2A2CSNK2BCSNK2A1
SCHEMBL31356554 0.81 CSNK2A2 (1.00) MAPTTP53CSNK2A2CSNK2BCSNK2A1

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
CN-111751465-B Rapid quantitative screening method and application of liquorice antioxidant active ingredients 山东大学第二医院 2022-01-11 CN disclosed
CN-111751465-A Rapid quantitative screening method and application of liquorice antioxidant active ingredients 山东省中医药研究院 2020-10-09 CN disclosed