SCHEMBL3303192

SCHEMBL3303192

N#Cc1ccc(-n2ccc3cc(N(CC(=O)O)S(=O)(=O)c4cc(Cl)cc(Cl)c4)ccc32)nc1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 3/20 0.37
NFE2L2 Q16236 3/20 0.37
BRPF1 P55201 2/20 0.36
BRD1 O95696 1/20 0.36
RORC P51449 2/20 0.36
FFAR4 Q5NUL3 1/20 0.35
CDC7 O00311 2/20 0.35
SIRT2 Q8IXJ6 2/20 0.35
TRPM8 Q7Z2W7 1/20 0.35
IRAK4 Q9NWZ3 2/20 0.34
DAGLA Q9Y4D2 1/20 0.34
KDM1A O60341 1/20 0.33
PLAU P00749 1/20 0.33
HCRTR2 O43614 1/20 0.33

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
SCHEMBL13390272 0.89 IRAK4 (0.36) BRPF1BRD1RORCCDC7SIRT2
SCHEMBL3299069 0.88 PLAU (0.35) KEAP1NFE2L2PLAU
SCHEMBL3303970 0.88 CDC7 (0.39) KEAP1NFE2L2BRPF1BRD1RORC
SCHEMBL13218567 0.87 BRPF1 (0.36) BRPF1BRD1RORCFFAR4CDC7
SCHEMBL13391266 0.87 PLAU (0.36) KEAP1NFE2L2PLAU
SCHEMBL4430338 0.87 KEAP1 (0.43) KEAP1NFE2L2HCRTR2
SCHEMBL3302886 0.86 KEAP1 (0.38) KEAP1NFE2L2PLAU
SCHEMBL3296209 0.86 KEAP1 (0.35) KEAP1NFE2L2PLAU
SCHEMBL13391822 0.86 BRPF1 (0.35) BRPF1BRD1RORCFFAR4CDC7
SCHEMBL3297213 0.85 KEAP1 (0.36) KEAP1NFE2L2PLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2121600-B1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INT (DE) 2012-07-18 EP disclosed
US-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-15 US disclosed
US-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-15 US disclosed
US-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-15 US disclosed
EP-2121600-A2 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS Boehringer Ingelheim International GmbH (DE) 2009-11-25 EP disclosed
WO-2008099000-A2 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-08-21 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-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS PYGL, PYGM, G6PC1 KEAP1 1594/4885NFE2L2 4427/4885BRPF1 3781/4885

“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.