SCHEMBL1779983

SCHEMBL1779983

NC1=NS(=O)(=O)Oc2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
GPR3 P46089 1/20 0.31
PKM P14618 1/20 0.31
TSHR P16473 1/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30
ALDH1A1 P00352 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
NOS3 P29474 1/20 0.30
NOS2 P35228 1/20 0.30
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL1782628 0.74 LMNA (0.33) ALDH1A1KDM4ELMNA
SCHEMBL28960027 0.69 STK17B (0.37) ALDH1A1L3MBTL1KDM4ETDP1
SCHEMBL30026278 0.69 STK17B (0.37) ALDH1A1L3MBTL1KDM4ETDP1
SCHEMBL28960028 0.69 STK17B (0.37) ALDH1A1L3MBTL1KDM4ETDP1
SCHEMBL25527501 0.68 POLB (0.44) TSHRALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL7771836 0.68 CA12 (0.32) CA12CA9
SCHEMBL7771834 0.68 AKR1B1 (0.35) CYP1A2PKMTSHRCA12CA2
SCHEMBL3380497 0.68 HSP90AA1 (0.40) GPR3PKMTSHRCA12CA1
SCHEMBL299692 0.65 ALDH1A1 (0.50) GPR3PKMTSHRALDH1A1L3MBTL1
SCHEMBL29695488 0.65 ALDH1A1 (0.50) GPR3PKMTSHRALDH1A1L3MBTL1

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 CYP1A2 1098/4885CYP2D6 2385/4885GPR3 1280/4885
US-20110118240-A2 4-Amino-1,2,3-Benzoxathiazine-Derivatives as Pesticides P2RX5, P2RX4, SLC1A5 CYP1A2 934/4885CYP2D6 1763/4885GPR3 1142/4885

“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.