SCHEMBL7957193

SCHEMBL7957193

Nc1cc(S(=O)(=O)c2ccccc2)ccc1S(N)(=O)=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.52
CA12 O43570 3/20 0.52
CA1 P00915 3/20 0.52
CA7 P43166 3/20 0.52
CA4 P22748 2/20 0.52
CA6 P23280 2/20 0.52
CA5A P35218 2/20 0.52
CA9 Q16790 2/20 0.52
CA14 Q9ULX7 2/20 0.52
CA5B Q9Y2D0 2/20 0.52
CYP2C9 P11712 1/20 0.52
HTR6 P50406 7/20 0.52
GAA P10253 2/20 0.52
MAPT P10636 2/20 0.52
ALDH1A1 P00352 3/20 0.50
PKM P14618 2/20 0.50
CA13 Q8N1Q1 2/20 0.47
CA3 P07451 1/20 0.47
PLA2G7 Q13093 1/20 0.47
KDM4E B2RXH2 1/20 0.47

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
SCHEMBL4952927 0.87 HTR6 (0.67) CA2CA12CA1CA7CA4
SCHEMBL4954260 0.86 LMNA (0.67) CA2CA12CA1CA7CA4
SCHEMBL9818530 0.86 HTR6 (0.61) CA2CA12CA1CA7CA4
SCHEMBL30166976 0.81 HTR6 (0.74) CA2CA12CA1CA7CA4
SCHEMBL950448 0.81 HTR6 (0.74) CA2CA12CA1CA7CA4
SCHEMBL9155404 0.81 LMNA (0.54) CA2CA12CA1CA7CA4
SCHEMBL1806178 0.81 CA2 (0.63) CA2CA12CA1CA7CA4
SCHEMBL565124 0.80 GAA (0.81) CA2CA12CA1CA7CA4
SCHEMBL7559625 0.78 HTR6 (0.66) CYP2C9HTR6GAAMAPTALDH1A1
SCHEMBL4617585 0.77 ALDH1A1 (0.60) CA2CA12CA1CA7CA4

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
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