SCHEMBL4733846

SCHEMBL4733846

Cc1ccc(S(=O)(=O)OC(C=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 1/20 0.40
ENPP3 O14638 1/20 0.40
ENPP1 P22413 1/20 0.40
ENPP2 Q13822 1/20 0.40
BCHE P06276 1/20 0.39
ACHE P22303 1/20 0.39
KMT2A Q03164 4/20 0.38
USP2 O75604 1/20 0.38
GFER P55789 1/20 0.38
LMNA P02545 2/20 0.38
CNR2 P34972 1/20 0.38
KDM4E B2RXH2 1/20 0.38
TP53 P04637 2/20 0.36
MAPT P10636 2/20 0.36
GAA P10253 2/20 0.36
MEN1 O00255 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 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
SCHEMBL4731994 0.85 ACHE (0.39) BCHEACHEKMT2AUSP2LMNA
SCHEMBL4733624 0.85 VDR (0.42) KMT2ALMNAGAAMEN1CYP2D6
SCHEMBL4730901 0.84 ALDH1A1 (0.46) BCHEACHEKMT2ALMNAKDM4E
SCHEMBL4731504 0.83 MAPT (0.41) KMT2ATP53MAPTGAAMEN1
SCHEMBL4729274 0.80 LMNA (0.51) ENPP3ENPP1ENPP2KMT2ALMNA
SCHEMBL4728806 0.78 HTT (0.43) ENPP2KMT2ALMNAGAAMEN1
SCHEMBL4731943 0.78 ADRB2 (0.35) CNR2CYP3A4ALDH1A1
SCHEMBL4734492 0.77 VDR (0.38) KMT2ALMNATP53MAPTGAA
SCHEMBL4732119 0.76 AR (0.54) LMNACNR2MAPTCYP1A2CYP3A4
SCHEMBL19716790 0.74 ENPP3 (0.43) UTS2RENPP3ENPP1ENPP2KMT2A

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