SCHEMBL7952991

SCHEMBL7952991

Nc1c(Cl)cc(Cl)cc1S(N)(=O)=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 2/20 0.67
POLB P06746 1/20 0.67
TDP1 Q9NUW8 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
CA1 P00915 13/20 0.64
CA2 P00918 13/20 0.64
CA4 P22748 6/20 0.57
CA9 Q16790 11/20 0.56
CYP2C19 P33261 1/20 0.52
CA12 O43570 6/20 0.52
CA6 P23280 5/20 0.52
CA5A P35218 5/20 0.52
CA7 P43166 5/20 0.52
CA14 Q9ULX7 5/20 0.52
CA5B Q9Y2D0 5/20 0.52
CA3 P07451 3/20 0.52
ALDH1A1 P00352 2/20 0.50
KDM4E B2RXH2 1/20 0.50
CA13 Q8N1Q1 3/20 0.45
LMNA P02545 1/20 0.45

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
SCHEMBL21999840 0.82 CA1 (0.48) APEX1POLBTDP1L3MBTL1CA1
SCHEMBL77983 0.82 CA1 (0.67) APEX1POLBTDP1L3MBTL1CA1
SCHEMBL8516285 0.81 CA1 (0.52) APEX1POLBTDP1L3MBTL1CA1
SCHEMBL1804696 0.80 CA1 (0.62) APEX1POLBTDP1L3MBTL1CA1
SCHEMBL1957301 0.80 CA1 (0.52) APEX1POLBTDP1L3MBTL1CA1
SCHEMBL9518035 0.80 APEX1 (1.00) APEX1POLBTDP1L3MBTL1CA1
SCHEMBL1804698 0.78 CA1 (1.00) CA1CA2CA9CA12ALDH1A1
SCHEMBL31070438 0.78 CA1 (1.00) CA1CA2CA9CA12ALDH1A1
SCHEMBL2919577 0.78 CA2 (0.48) APEX1POLBTDP1L3MBTL1CA1
SCHEMBL11689095 0.75 ACLY (0.46) APEX1POLBTDP1L3MBTL1CA1

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
CN-113121470-A Preparation method of benzothiadiazine-1, 1-dioxide compound 天津理工大学 2021-07-16 CN 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