SCHEMBL3498665

SCHEMBL3498665

Cc1cccc(S(=O)(=O)OCC[C@H]2COC(C)(C)O2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.42
PRMT5 O14744 1/20 0.39
WDR77 Q9BQA1 1/20 0.39
ALDH1A1 P00352 4/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
KDM4E B2RXH2 2/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
ALOX15 P16050 1/20 0.36
MAPK1 P28482 1/20 0.36
CASP1 P29466 1/20 0.36
BLM P54132 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL3490631 0.85 CA2 (0.46) CA2ALDH1A1HTTKDM4EHPGD
SCHEMBL2724163 0.85 CA2 (0.46) CA2ALDH1A1HTTKDM4EHPGD
SCHEMBL879857 0.85 CA2 (0.46) CA2ALDH1A1HTTKDM4EHPGD
SCHEMBL6714976 0.82 CA2 (0.41) CA2PRMT5WDR77ALDH1A1LMNA
SCHEMBL2859063 0.80 CA2 (0.41) CA2ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL23827433 0.78 CA2 (0.44) CA2ALDH1A1HTTKDM4EHPGD
SCHEMBL9281309 0.78 CA2 (0.44) CA2ALDH1A1HTTKDM4EHPGD
SCHEMBL7165666 0.77 CA2 (0.43) CA2ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL31688970 0.77 CA2 (0.43) CA2ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL2885300 0.77 CA2 (0.43) CA2PRMT5WDR77ALDH1A1HTT

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
US-20100121056-A1 PSEUDONUCLEOTIDE COMPRISING AN INTERCALATOR HUMAN GENETIC SIGNATURES PTY. LTD. (AU) 2010-05-13 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-20100121056-A1 PSEUDONUCLEOTIDE COMPRISING AN INTERCALATOR POLRMT, POLN, RNASE1 CA2 2354/4885PRMT5 3882/4885WDR77 2707/4885

“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.