SCHEMBL2534458

SCHEMBL2534458

Cc1ccc(S(=O)(=O)OC[C@@H](O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 1/20 0.42
KMT2A Q03164 2/20 0.42
ENPP3 O14638 1/20 0.41
ENPP1 P22413 1/20 0.41
ENPP2 Q13822 1/20 0.41
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
EGFR P00533 1/20 0.41
ERBB2 P04626 1/20 0.41
ALDH1A1 P00352 3/20 0.40
GAA P10253 1/20 0.40
LMNA P02545 3/20 0.40
CNR2 P34972 2/20 0.40
PKM P14618 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPT P10636 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL2545371 1.00 UTS2R (0.42) UTS2RKMT2AENPP3ENPP1ENPP2
SCHEMBL2539995 0.93 PKM (0.44) KMT2AENPP3ENPP1ENPP2BCHE
SCHEMBL6980265 0.93 PKM (0.44) KMT2AENPP3ENPP1ENPP2BCHE
SCHEMBL3181029 0.86 ALDH1A1 (0.42) KMT2ABCHEACHEEGFRERBB2
SCHEMBL2539955 0.86 ALDH1A1 (0.42) KMT2ABCHEACHEEGFRERBB2
SCHEMBL3181035 0.86 ALDH1A1 (0.42) KMT2ABCHEACHEEGFRERBB2
SCHEMBL2545829 0.85 PKM (0.53) KMT2AALDH1A1LMNAPKMHTT
SCHEMBL4920359 0.85 PKM (0.53) KMT2AALDH1A1LMNAPKMHTT
SCHEMBL1206501 0.85 PKM (0.53) KMT2AALDH1A1LMNAPKMHTT
SCHEMBL2538585 0.84 ALDH1A1 (0.51) KMT2ABCHEACHEEGFRALDH1A1

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
US-8044245-B2 Method for the preparation of optically active 2-sulfonyloxy-1-phenylethanol derivatives KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2011-10-25 US disclosed
US-20100063317-A1 METHOD FOR THE PREPARATION OF OPTICALLY ACTIVE 2-SULFONYLOXY-1-PHENYLETHANOL DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2010-03-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100063317-A1 METHOD FOR THE PREPARATION OF OPTICALLY ACTIVE 2-SULFONYLOXY-1-PHENYLETHANOL DERIVATIVES FOXO1, ENO1, SULT1A1 UTS2R 4141/4885KMT2A 2462/4885ENPP3 498/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.