SCHEMBL2536191

SCHEMBL2536191

CC(=O)Oc1ccc([C@@H](O)COS(C)(=O)=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
POLB P06746 1/20 0.47
PKM P14618 1/20 0.47
LMNA P02545 3/20 0.43
KDM4E B2RXH2 2/20 0.43
CYP3A4 P08684 2/20 0.43
ESR1 P03372 2/20 0.43
HIF1A Q16665 2/20 0.43
ABCB11 O95342 1/20 0.43
ADRA2A P08913 1/20 0.43
CYP2C9 P11712 1/20 0.43
TSHR P16473 1/20 0.43
PDE4A P27815 1/20 0.43
ADRA1A P35348 1/20 0.43
OPRK1 P41145 1/20 0.43
STAT6 P42226 1/20 0.43
SLC6A3 Q01959 1/20 0.43
GPR55 Q9Y2T6 1/20 0.43
MEN1 O00255 1/20 0.40
TTR P02766 1/20 0.40

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
SCHEMBL2539325 1.00 MAPT (0.47) MAPTPOLBPKMLMNAKDM4E
SCHEMBL2543561 0.83 AOC3 (0.50) MAPTPOLBPKMALDH1A1GAA
SCHEMBL2539306 0.83 AOC3 (0.50) MAPTPOLBPKMALDH1A1GAA
SCHEMBL2539962 0.81 LMNA (0.51) MAPTPOLBPKMLMNAKDM4E
SCHEMBL14646436 0.79 ALDH1A1 (0.40) MAPTPKMLMNAKDM4EMEN1
SCHEMBL7039011 0.79 SRD5A2 (0.45) LMNAPDE4ASMN1; SMN2CA2
SCHEMBL5157831 0.78 AOC3 (0.45) LMNAKDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL2541787 0.78 AOC3 (0.45) LMNAKDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL2538436 0.78 AOC3 (0.45) LMNAKDM4EMEN1KMT2AALDH1A1
SCHEMBL5157835 0.78 AOC3 (0.45) LMNAKDM4EMEN1KMT2ASMN1; SMN2

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 MAPT 4643/4885POLB 2503/4885PKM 394/4885

“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.