SCHEMBL6553116

SCHEMBL6553116

CSC1=NS(=O)(=O)c2ccccc2N1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.62
CA1 P00915 3/20 0.62
CA2 P00918 3/20 0.62
CA9 Q16790 3/20 0.62
TAAR1 Q96RJ0 1/20 0.48
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
NOX1 Q9Y5S8 1/20 0.46
ALDH1A1 P00352 2/20 0.45
USP2 O75604 1/20 0.43
CA4 P22748 1/20 0.41
CA7 P43166 1/20 0.41
PLCG1 P19174 1/20 0.39
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
THRB P10828 1/20 0.37
TSHR P16473 1/20 0.37
ABCC8 Q09428 1/20 0.37

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
SCHEMBL8578033 0.82 CA12 (0.57) CA12CA1CA2CA9TAAR1
SCHEMBL8631675 0.80 CA12 (0.62) CA12CA1CA2CA9TAAR1
SCHEMBL24050733 0.80 ABCC8 (0.53) CA12CA1CA2CA9TAAR1
SCHEMBL8624743 0.79 CA12 (0.38) CA12CA1CA2CA9TAAR1
SCHEMBL25916150 0.79 ALDH1A1 (0.48) CA12CA1CA2CA9TAAR1
Water SCHEMBL6617511 0.78 CA12 (0.37) CA12CA1CA2CA9TAAR1
SCHEMBL25328097 0.78 L3MBTL1 (0.53) CA12CA1CA2CA9TAAR1
SCHEMBL7950864 0.78 ABCC8 (0.66) CA12CA1CA2CA9TAAR1
SCHEMBL10118553 0.77 CA12 (1.00) CA12CA1CA2CA9TAAR1
SCHEMBL8603703 0.75 TAAR1 (0.51) CA12CA1CA2CA9TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-4600720-A HISTAMINE H2-ANTOAGONISTS, ANTISECRETORY; THIAZOLINE, QUINAZOLINE, QUINOLINE, PYRIMIDINE DERIVATIVES SMITH KLINE & FRENCH LABORATORIES LTD. (GB) 1986-07-15 US disclosed
US-4578459-A HISTAMINE H2-ANTAGONISTS SMITHKLINE & FRENCH LABORATORIES LIMITED (GB) 1986-03-25 US disclosed
EP-0172968-A1 Aminothiadiazine derivatives as histamine H2-antagonists SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1986-03-05 EP disclosed
US-4537779-A HISTAMINE H2-ANTAGONISTS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1985-08-27 US disclosed
US-4467087-A ANTIHISTAMINES SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1984-08-21 US disclosed
US-4399142-A ANTIHISTAMINES SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1983-08-16 US disclosed
US-4374251-A ANTIHISTAMINES SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1983-02-15 US disclosed
US-4341787-A ANTIHISTAMINES; ANTISECRETORY AGENTS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1982-07-27 US disclosed
US-4282221-A Pharmacologically active compounds to inhibit H-2 histamine receptors SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1981-08-04 US disclosed
US-4260744-A ANTIHISTAMINES SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1981-04-07 US disclosed
US-4181730-A ANTISECRETORY AGENTS, IMIDAZOLYALKYLIMIDAZOLINONES SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1980-01-01 US disclosed
US-4153793-A ANTIHISTAMINES SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1979-05-08 US disclosed
US-4104381-A HISTAMINE INHIBITORS, ((IMIDAZOLYLALKYL)AMINO)THIADIAZINES SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1978-08-01 US disclosed
US-4005205-A PYRIMIDINE COMPOUNDS SMITH KLINE & FRENCH LABORATORIES LIMITED (EN) 1977-01-25 US disclosed