SCHEMBL4547119

SCHEMBL4547119

Cc1cccc(C)c1NC(=O)C(NS(=O)(=O)c1ccc2[nH]c(=O)ccc2c1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OGT O15294 5/20 0.61
POLB P06746 3/20 0.61
TDP1 Q9NUW8 1/20 0.61
THRB P10828 2/20 0.53
PKM P14618 1/20 0.47
GAA P10253 1/20 0.47
ALDH1A1 P00352 1/20 0.47
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MAPT P10636 2/20 0.46
TP53 P04637 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
HPN P05981 2/20 0.43
PLAU P00749 1/20 0.43

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
SCHEMBL4547381 0.93 OGT (0.61) OGTPOLBTDP1THRBPKM
SCHEMBL4547120 0.93 OGT (0.64) OGTPOLBTDP1THRBPKM
SCHEMBL4547032 0.84 PKM (0.58) OGTPOLBTHRBPKMMAPT
SCHEMBL23815544 0.84 OGT (0.52) OGTPOLBTDP1THRBPKM
SCHEMBL17405139 0.83 OGT (0.53) OGTPOLBTHRBPKMGAA
SCHEMBL4547122 0.83 OGT (0.63) OGTPOLBTDP1THRBPKM
SCHEMBL13602282 0.80 PKM (0.63) OGTPOLBTHRBPKMMAPT
SCHEMBL4544679 0.78 OGT (0.63) OGTPOLBTHRBPKMMAPT
SCHEMBL4544695 0.78 OGT (0.63) OGTPOLBTHRBPKMGAA
SCHEMBL12973129 0.77 OGT (0.62) OGTPOLBTHRBPKMMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8957075-B2 O-GlcNAc transferase inhibitors and uses thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-02-17 US disclosed
US-20120108605-A1 O-GLCNAC TRANSFERASE INHIBITORS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-05-03 US disclosed
WO-2010141074-A2 O-GLCNAC TRANSFERASE INHIBITORS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-12-09 WO 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-20120108605-A1 O-GLCNAC TRANSFERASE INHIBITORS AND USES THEREOF OGA, OGT, UGGT1 OGT 2/4885POLB 3030/4885TDP1 1844/4885

“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.