SCHEMBL1781575

SCHEMBL1781575

CCOc1cccc2c1C(N)=NS(=O)(=O)O2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
MAPT P10636 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
KDM4E B2RXH2 2/20 0.35
PABPC1 P11940 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CYP2A6 P11509 1/20 0.35
NR3C1 P04150 1/20 0.34
PGR P06401 1/20 0.34
NR3C2 P08235 1/20 0.34
CA12 O43570 3/20 0.33
CA9 Q16790 3/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
TLR8 Q9NR97 1/20 0.33
PKM P14618 1/20 0.33
GLA P06280 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
SCHEMBL1783661 0.73 BACE1 (0.34)
SCHEMBL2419495 0.72 ALDH1A1 (0.39) ALDH1A1MAPTL3MBTL1NPSR1MEN1
SCHEMBL7929775 0.63 ALDH1A1 (0.52) ALDH1A1MAPTL3MBTL1NPSR1MEN1
SCHEMBL7930788 0.63 ALDH1A1 (0.64) ALDH1A1MAPTL3MBTL1NPSR1MEN1
SCHEMBL11139017 0.63 L3MBTL1 (0.56) ALDH1A1MAPTL3MBTL1NPSR1MEN1
SCHEMBL3411326 0.63 MAPT (0.42) ALDH1A1MAPTL3MBTL1MEN1KMT2A
SCHEMBL620629 0.62 MCHR1 (0.41) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL5155766 0.62 ALDH1A1 (0.43) ALDH1A1MAPTNPSR1MEN1KMT2A
SCHEMBL11905880 0.61 GRM5 (0.49) ALDH1A1MAPTL3MBTL1NPSR1MEN1
SCHEMBL1002382 0.61 LTA4H (0.59) ALDH1A1MAPTL3MBTL1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8173641-B2 4-amino-1,2,3-benzoxathiazine-derivatives as pesticides BAYER CROPSCIENCE AG (DE) 2012-05-08 US disclosed
US-8173641-B2 4-amino-1,2,3-benzoxathiazine-derivatives as pesticides BAYER CROPSCIENCE AG (DE) 2012-05-08 US disclosed
US-8173641-B2 4-amino-1,2,3-benzoxathiazine-derivatives as pesticides BAYER CROPSCIENCE AG (DE) 2012-05-08 US disclosed
US-20110118240-A2 4-Amino-1,2,3-Benzoxathiazine-Derivatives as Pesticides BAYER CROPSCIENCE AG (DE) 2011-05-19 US disclosed
US-20110118240-A2 4-Amino-1,2,3-Benzoxathiazine-Derivatives as Pesticides BAYER CROPSCIENCE AG (DE) 2011-05-19 US disclosed
US-20110118240-A2 4-Amino-1,2,3-Benzoxathiazine-Derivatives as Pesticides BAYER CROPSCIENCE AG (DE) 2011-05-19 US disclosed
US-20100267703-A1 4-Amino-1,2,3-benzoxathiazine-Derivatives as Pesticides BAYER CROPSCIENCE AG (DE) 2010-10-21 US disclosed
US-20100267703-A1 4-Amino-1,2,3-benzoxathiazine-Derivatives as Pesticides BAYER CROPSCIENCE AG (DE) 2010-10-21 US disclosed
US-20100267703-A1 4-Amino-1,2,3-benzoxathiazine-Derivatives as Pesticides BAYER CROPSCIENCE AG (DE) 2010-10-21 US disclosed
WO-2010072310-A1 4-AMINO-1,2,3- BENZOXATHIAZINE DERIVATIVES AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-07-01 WO disclosed
EP-2196461-A1 4-Amino-1,2,3-benzoxathiazine-derivatives as pesticides Bayer CropScience AG (DE) 2010-06-16 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-20100267703-A1 4-Amino-1,2,3-benzoxathiazine-Derivatives as Pesticides P2RX5, SLC1A5, P2RX4 ALDH1A1 2671/4885MAPT 3255/4885L3MBTL1 1505/4885
US-20110118240-A2 4-Amino-1,2,3-Benzoxathiazine-Derivatives as Pesticides P2RX5, P2RX4, SLC1A5 ALDH1A1 2519/4885MAPT 3327/4885L3MBTL1 1209/4885

“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.