SCHEMBL1807804

SCHEMBL1807804

Nc1cc(Cl)c(Cl)cc1S(N)(=O)=O

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 12/20 0.79
CA2 P00918 12/20 0.79
CA9 Q16790 10/20 0.79
CA4 P22748 8/20 0.79
CA12 O43570 7/20 0.79
CA6 P23280 7/20 0.79
CA5A P35218 7/20 0.79
CA7 P43166 7/20 0.79
CA14 Q9ULX7 7/20 0.79
CA5B Q9Y2D0 7/20 0.79
CA3 P07451 3/20 0.79
APEX1 P27695 2/20 0.52
POLB P06746 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
ALDH1A1 P00352 3/20 0.50
CA13 Q8N1Q1 3/20 0.47
CYP2C9 P11712 2/20 0.47
LMNA P02545 1/20 0.47
GAA P10253 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
SCHEMBL30659050 0.88 CA1 (1.00) CA1CA2CA9CA4CA12
SCHEMBL310205 0.88 CA1 (1.00) CA1CA2CA9CA4CA12
SCHEMBL29376122 0.88 CA1 (1.00) CA1CA2CA9CA4CA12
SCHEMBL3500908 0.85 CA1 (0.56) CA1CA2CA9CA4CA12
SCHEMBL1806519 0.84 CA1 (0.76) CA1CA2CA9CA4CA12
SCHEMBL1806789 0.83 CA1 (0.62) CA1CA2CA9CA4CA12
SCHEMBL3778122 0.83 CA1 (0.62) CA1CA2CA9CA4CA12
SCHEMBL1806979 0.83 CA1 (0.68) CA1CA2CA9CA4CA12
SCHEMBL11797294 0.83 CA1 (0.68) CA1CA2CA9CA4CA12
SCHEMBL3273469 0.83 CA1 (0.68) CA1CA2CA9CA4CA12

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8404036-B2 Water-soluble near-infrared absorbing coloring matters and aqueous inks containing same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2013-03-26 US disclosed
US-20110123784-A1 WATER-SOLUBLE NEAR-INFRARED ABSORBING COLORING MATTERS AND AQUEOUS INKS CONTAINING SAME NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-05-26 US disclosed
EP-2147915-B1 New cycloalkylated benzothiadiazine derivatives, method of preparing same and pharmaceutical compositions containing them SERVIER LAB (FR) 2010-09-15 EP disclosed
US-7741320-B2 Cycloalkylated benzothiadiazines, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2010-06-22 US disclosed
EP-2147915-A1 New cycloalkylated benzothiadiazine derivatives, method of preparing same and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2010-01-27 EP disclosed
WO-2010004139-A1 NEW CYCLOALKYLATED BENZOTHIADIAZINE DERIVATIVES, METHOD FOR PREPARING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM LES LABORATOIRES SERVIER (FR) 2010-01-14 WO disclosed
US-20100009974-A1 Cycloalkylated benzothiadiazines, a process for their preparation and pharmaceutical compostions containing them LES LABORATOIRES SERVIER (FR) 2010-01-14 US disclosed
US-7268129-B2 Fluorinated benzothiadiazine compounds LES LABORATOIRES SERVIER (FR) 2007-09-11 US disclosed
CN-1308317-C New fluorinated benzothiadiazine compounds, a process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2007-04-04 CN disclosed
CN-1680343-A New fluorinated benzothiadiazine compounds, a process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2005-10-12 CN disclosed
EP-0906297-B1 1,2,4-BENZOTHIADIAZINE DERIVATIVES, THEIR PREPARATION AND USE UNIV LIEGE (BE) 2004-02-25 EP disclosed
CN-1081633-C 1,2, 4-benzothiadiazine derivatives, method for preparing same and use thereof NOVO NORDISK AS (DK) 2002-03-27 CN disclosed
US-6242443-B1 1,2,4-benzothiadiazine derivatives, their preparation and use NOVO NORDISK AIS (DK) 2001-06-05 US disclosed
CN-1222910-A 1,2, 4-benzothiadiazine derivatives, method for preparing same and use thereof NOVO NORDISK AS (DK) 1999-07-14 CN disclosed
EP-0906297-A1 1,2,4-BENZOTHIADIAZINE DERIVATIVES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1999-04-07 EP disclosed
WO-1997049692-A1 1,2,4-BENZOTHIADIAZINE DERIVATIVES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1997-12-31 WO disclosed
EP-0636124-A1 3,4-DIHYDRO-2H-1,2,4-BENZOTHIADIAZINE-1,1-DIOXIDE-3-CARBOXYLIC ACID DERIVATIVES, PREPARATION THEREOF AND DRUGS CONTAINING SAME Aventis Pharma S.A. (FR) 1995-02-01 EP disclosed
WO-1993021170-A1 3,4-DIHYDRO-2H-1,2,4-BENZOTHIADIAZINE-1,1-DIOXIDE-3-CARBOXYLIC ACID DERIVATIVES, PREPARATION THEREOF AND DRUGS CONTAINING SAME RHONE-POULENC RORER S.A. (FR) 1993-10-28 WO disclosed
US-4997833-A Aryloxy-aminoalkanes, and antihypertensive use thereof BOEHRINGER INGELHEIM K G (DE) 1991-03-05 US disclosed
EP-0264639-A1 Aryloxyaminoalkanes, their preparation and use BOEHRINGER INGELHEIM KG (DE) 1988-04-27 EP 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 (2 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-20110123784-A1 WATER-SOLUBLE NEAR-INFRARED ABSORBING COLORING MATTERS AND AQUEOUS INKS CONTAINING SAME IK, RB1, COL1A1 CA1 798/4885CA2 1279/4885CA9 1071/4885
US-20100009974-A1 Cycloalkylated benzothiadiazines, a process for their preparation and pharmaceutical compostions containing them ACLY, HCAR1, GABRG1 CA1 3557/4885CA2 1509/4885CA9 3951/4885

“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.