SCHEMBL1782414

SCHEMBL1782414

CNc1noc2cccc(OC)c12

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 3/20 0.58
SGMS2 Q8NHU3 5/20 0.46
SGMS1 Q86VZ5 3/20 0.46
KAT6A Q92794 10/20 0.43
KAT7 O95251 9/20 0.43
KAT6B Q8WYB5 4/20 0.43
MAOA P21397 1/20 0.41
NQO1 P15559 1/20 0.40
KAT5 Q92993 1/20 0.40
KAT8 Q9H7Z6 1/20 0.40

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
SCHEMBL1784179 0.83 SGMS2 (0.46) KCNA5SGMS2SGMS1KAT6AKAT7
SCHEMBL14012657 0.83 KCNA5 (0.61) KCNA5SGMS2SGMS1KAT6AKAT7
SCHEMBL19706541 0.80 KCNA5 (0.52) KCNA5SGMS2SGMS1KAT6AKAT7
SCHEMBL29652565 0.78 KAT6A (0.64) KAT6AKAT7KAT6BKAT5KAT8
SCHEMBL21609079 0.78 KAT6A (0.64) KAT6AKAT7KAT6BKAT5KAT8
SCHEMBL19736141 0.78 KCNA5 (0.50) KCNA5SGMS2SGMS1KAT6AKAT7
SCHEMBL31605622 0.78 KAT6A (0.58) KAT6AKAT7KAT6BKAT5KAT8
SCHEMBL21641918 0.78 KAT6A (0.58) KAT6AKAT7KAT6BKAT5KAT8
SCHEMBL10583963 0.77 KCNA5 (0.48) KCNA5SGMS2SGMS1MAOANQO1
SCHEMBL6886413 0.77 KCNA5 (0.48) KCNA5MAOANQO1

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 12 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
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 KCNA5 299/4885SGMS2 2604/4885SGMS1 2350/4885
US-20110118240-A2 4-Amino-1,2,3-Benzoxathiazine-Derivatives as Pesticides P2RX5, P2RX4, SLC1A5 KCNA5 192/4885SGMS2 2496/4885SGMS1 2269/4885

“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.