SCHEMBL6505477

SCHEMBL6505477

O=S1(=O)N=CNc2ccc(Br)cc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.58
CA2 P00918 4/20 0.58
CA12 O43570 3/20 0.58
CA9 Q16790 3/20 0.58
AKR1B1 P15121 1/20 0.48
LMNA P02545 2/20 0.44
CYP3A4 P08684 2/20 0.44
TSHR P16473 2/20 0.44
NFKB1 P19838 1/20 0.44
BLM P54132 1/20 0.44
CA4 P22748 1/20 0.44
CA7 P43166 1/20 0.44
SHMT2 P34897 1/20 0.41
NOS1 P29475 2/20 0.34
METAP2 P50579 2/20 0.34
CSNK2A1 P68400 1/20 0.34
CYP2D6 P10635 2/20 0.33
TGM2 P21980 1/20 0.33
CES1 P23141 1/20 0.33
CYP2C9 P11712 1/20 0.33

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
SCHEMBL10082924 0.86 CA1 (0.58) CA1CA2CA12CA9AKR1B1
SCHEMBL6496816 0.79 CA1 (0.58) CA1CA2CA12CA9AKR1B1
SCHEMBL2776254 0.79 CA1 (0.58) CA1CA2CA12CA9AKR1B1
SCHEMBL28961017 0.79 CA1 (0.58) CA1CA2CA12CA9AKR1B1
SCHEMBL2777400 0.79 CA1 (0.58) CA1CA2CA12CA9AKR1B1
SCHEMBL30070404 0.79 CA1 (0.58) CA1CA2CA12CA9AKR1B1
SCHEMBL5184948 0.75 SHMT2 (0.61) CA1CA2CA12CA9LMNA
SCHEMBL17350895 0.73 CA1 (0.57) CA1CA2CA12CA9AKR1B1
SCHEMBL28960469 0.73 CA12 (0.51) CA1CA2CA12CA9AKR1B1
SCHEMBL30070366 0.73 CA12 (0.51) CA1CA2CA12CA9AKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104761514-B 1,1-dioxo-4H-benzo [1,2,4]-thiadiazine hydrochlorate compounds and preparation method thereof 河南师范大学 2016-11-23 CN claimed
CN-117946012-A Preparation method of nitrogen-containing heterocycle 温州理工学院 2024-04-30 CN disclosed
WO-2023146511-A1 COMPOUNDS AND METHODS OF USE THEREOF VIVACE THERAPEUTICS, INC. (US) 2023-08-03 WO disclosed
WO-2023146511-A1 COMPOUNDS AND METHODS OF USE THEREOF VIVACE THERAPEUTICS, INC. (US) 2023-08-03 WO disclosed
CN-104761514-B 1,1-dioxo-4H-benzo [1,2,4]-thiadiazine hydrochlorate compounds and preparation method thereof 河南师范大学 2016-11-23 CN disclosed
US-6894043-B1 Benzothiadiazine derivatives, preparation method and pharmaceutical compositions containing same LES LABORATOIRES SERVIER (FR) 2005-05-17 US disclosed
CN-1162414-C Benzothiadiazine derivs., preparation method and pharmaceutical compositions contg. same ɪά��ʵ���� 2004-08-18 CN disclosed
EP-1233953-B1 NOVEL BENZOTHIADIAZINE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SERVIER LAB (FR) 2003-05-14 EP disclosed
CN-1402717-A Benzothiadiazine derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2003-03-12 CN disclosed