SCHEMBL2846115

SCHEMBL2846115

Cc1nn(S(=O)(=O)c2cc(Cl)cc(Cl)c2)c2ccc(NS(=O)(=O)c3cc(Cl)cc(Cl)c3)cc12

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 6/20 0.46
PSEN2 P49810 6/20 0.46
APH1B Q8WW43 6/20 0.46
NCSTN Q92542 6/20 0.46
APH1A Q96BI3 6/20 0.46
PSENEN Q9NZ42 6/20 0.46
CYP3A4 P08684 7/20 0.46
CYP2D6 P10635 6/20 0.46
MAPT P10636 1/20 0.44
HTR6 P50406 3/20 0.43
PGR P06401 2/20 0.41
PKM P14618 1/20 0.41
EDNRB P24530 1/20 0.41
EDNRA P25101 1/20 0.41
ACLY P53396 1/20 0.41

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
SCHEMBL2967385 0.79 CYP3A4 (0.42) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2967390 0.73 CYP3A4 (0.37) CYP3A4CYP2D6MAPTACLY
SCHEMBL3303810 0.72 CYP3A4 (0.54) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2852627 0.69 TRIM24 (0.71) PKM
SCHEMBL13106722 0.69 ACLY (0.50) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2846293 0.69 MAPT (0.73) CYP3A4CYP2D6MAPTPGR
SCHEMBL11957195 0.68 CYP3A4 (0.44) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3299102 0.68 BRD4 (0.51) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3304239 0.68 HTR6 (0.62) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2845061 0.67 LMNA (0.64) PSEN1PSEN2APH1BNCSTNAPH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8232312-B2 Substituted arylsulphonylglycines, the preparation thereof and the use thereof as pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-07-31 US disclosed
EP-2125718-B1 NEW SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INT (DE) 2010-09-15 EP disclosed
US-20100130557-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-05-27 US disclosed
EP-2125718-A2 NEW SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS Boehringer Ingelheim International GmbH (DE) 2009-12-02 EP disclosed
WO-2008113760-A2 ARYLSULPHONYGLYCINE DERIVATIVES AS SUPPRESSORS OF THE INTERACTION OF GLYCOGEN PHOSPHORYLASE A WITH THE GL SUBUNIT OF GLYCOGEN-ASSOCIATED PROTEIN PHOSPHATASE 1 (PPL) FOR THE TREATMENT OF METABOLIC DISORDERS, PARTICULARY DIABETES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-09-25 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-20100130557-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS PYGL, PYGM, G6PC1 PSEN1 217/4885PSEN2 824/4885APH1B 2596/4885

“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.