SCHEMBL4729274

SCHEMBL4729274

CC(=O)Oc1ccc(C(C=O)OS(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.51
MAPT P10636 3/20 0.48
POLB P06746 2/20 0.48
PKM P14618 1/20 0.48
ALDH1A1 P00352 2/20 0.46
KMT2A Q03164 5/20 0.40
MEN1 O00255 2/20 0.38
KDM4E B2RXH2 2/20 0.38
CYP3A4 P08684 2/20 0.38
TTR P02766 1/20 0.38
TP53 P04637 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PTGS2 P35354 2/20 0.37
HTT P42858 1/20 0.37
ENPP3 O14638 2/20 0.36
ENPP1 P22413 2/20 0.36
ENPP2 Q13822 2/20 0.36
HSD17B10 Q99714 1/20 0.36
ESR1 P03372 2/20 0.36
SLC6A3 Q01959 2/20 0.36

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
SCHEMBL4730901 0.84 ALDH1A1 (0.46) LMNAMAPTPKMALDH1A1KMT2A
SCHEMBL29042707 0.83 LMNA (0.56) LMNAMAPTPOLBPKMALDH1A1
SCHEMBL4732303 0.81 MAPT (0.47) LMNAMAPTPOLBPKMALDH1A1
SCHEMBL4733846 0.80 UTS2R (0.40) LMNAMAPTALDH1A1KMT2AMEN1
SCHEMBL4731994 0.80 ACHE (0.39) LMNAALDH1A1KMT2AMEN1TP53
SCHEMBL4731826 0.80 LMNA (0.51) LMNAMAPTPOLBPKMALDH1A1
SCHEMBL1825138 0.80 KMT2A (0.47) LMNAMAPTALDH1A1KMT2AMEN1
SCHEMBL4733624 0.79 VDR (0.42) LMNAPKMALDH1A1KMT2AMEN1
SCHEMBL2539962 0.77 LMNA (0.51) LMNAMAPTPOLBPKMALDH1A1
SCHEMBL25138830 0.76 LMNA (0.67) LMNAMAPTPOLBPKMALDH1A1

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-2008054155-A1 METHOD FOR THE PREPARATION OF OPTICALLY ACTIVE 2-SULFONYLOXY-1-PHENYLETHANOL DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2008-05-08 WO disclosed