SCHEMBL242874

SCHEMBL242874

O=S(=O)([N]S(=O)(=O)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F2 P00734 5/20 0.38
PRSS1 P07477 5/20 0.38
PRSS2 P07478 5/20 0.38
PRSS3 P35030 5/20 0.38
CA2 P00918 3/20 0.37
CA1 P00915 2/20 0.37
CA7 P43166 1/20 0.37
CA13 Q8N1Q1 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
Lithium Ion SCHEMBL1248473 0.97 F2 (0.36) F2PRSS1PRSS2PRSS3CA2
Lithium Ion SCHEMBL3153428 0.91 F2 (0.39) F2PRSS1PRSS2PRSS3CA2
SCHEMBL1990018 0.79 F2 (0.46) F2PRSS1PRSS2PRSS3CA2
Lithium Ion SCHEMBL6114090 0.79 F2 (0.46) F2PRSS1PRSS2PRSS3CA2
Potassium Ion SCHEMBL1989928 0.79 F2 (0.46) F2PRSS1PRSS2PRSS3CA2
Lithium Ion SCHEMBL3147600 0.79 F2 (0.42) F2PRSS1PRSS2PRSS3CA2
SCHEMBL128223 0.79 F2 (0.48) F2PRSS1PRSS2PRSS3CA2
Lithium Ion SCHEMBL1245900 0.77 F2 (0.50) F2PRSS1PRSS2PRSS3CA2
SCHEMBL8985757 0.77 F2 (0.59) F2PRSS1PRSS2PRSS3CA2
SCHEMBL1997714 0.77 F2 (0.56) F2PRSS1PRSS2PRSS3CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8084613-B2 Tetrazoyloxime derivative and plant disease control agent NIPPON SODA CO., LTD. (JP) 2011-12-27 US claimed
EP-2687088-B1 AQUEOUS HORTICULTURAL MICROBICIDAL COMPOSITION SUSPENSION NIPPON SODA CO (JP) 2018-08-01 EP disclosed
US-9926274-B2 Process for producing substituted methylamine compound and triazine derivative NIPPON SODA CO., LTD. (JP) 2018-03-27 US disclosed
EP-2650283-B1 Process for producing substituted methylamine compound and triazine derivative NIPPON SODA CO (JP) 2017-06-07 EP disclosed
US-9630933-B2 Method for producing 1-H-tetrazole derivative NIPPON SODA CO., LTD. (JP) 2017-04-25 US disclosed
EP-2845853-B1 METHOD FOR PRODUCING 1H-TETRAZOLE DERIVATIVE NIPPON SODA CO (JP) 2017-01-25 EP disclosed
EP-2826773-B1 COMPOUND, METHOD FOR PRODUCING COMPOUND, AND METHOD FOR PURIFYING COMPOUND NIPPON SODA CO (JP) 2016-11-02 EP disclosed
EP-2407461-B1 PROCESS FOR PREPARATION OF 1-ALKYL-5-BENZOYL-1H-TETRAZOLE DERIVATIVES NIPPON SODA CO (JP) 2016-05-18 EP disclosed
US-9233984-B2 Compound, method for producing compound, and method for purifying compound NIPPON SODA CO., LTD. (JP) 2016-01-12 US disclosed
US-20150322021-A1 METHOD FOR PRODUCING 1-H-TETRAZOLE DERIVATIVE NIPPON SODA CO., LTD. (JP) 2015-11-12 US disclosed
US-20100292483-A1 TETRAZOYLOXIME DERIVATIVE AND PLANT DISEASE CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2010-11-18 US disclosed
US-20100137594-A1 TETRAZOYLOXIME DERIVATIVE AND PLANT DISEASE CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2010-06-03 US disclosed
EP-2186804-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND PEST CONTROL AGENT Nippon Soda Co., Ltd. (JP) 2010-05-19 EP disclosed
US-20100121054-A1 PROCESS FOR PRODUCING SUBSTITUTED METHYLAMINE COMPOUND AND TRIAZINE DERIVATIVE NIPPON SODA CO., LTD. (JP) 2010-05-13 US disclosed
EP-2177519-A1 TETRAZOYLOXIME DERIVATIVE AND PLANT DISEASE CONTROL AGENT Nippon Soda Co., Ltd. (JP) 2010-04-21 EP disclosed
EP-2141149-A1 PROCESS FOR PRODUCING SUBSTITUTED METHYLAMINE COMPOUND AND TRIAZINE DERIVATIVE Nippon Soda Co., Ltd. (JP) 2010-01-06 EP disclosed
US-20090318694-A1 Cross-Linked Amine Compounds and Agents for Pest Control NIPPON SODA CO., LTD. (JP) 2009-12-24 US disclosed
US-20090259046-A1 Cyclic Amine Compounds and Agents for Pest Control NIPPON SODA CO., LTD. (JP) 2009-10-15 US disclosed
EP-1947098-A1 CYCLIC AMINE COMPOUNDS AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2008-07-23 EP disclosed
EP-1932844-A1 BRIDGED CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2008-06-18 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 (6 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-20150322021-A1 METHOD FOR PRODUCING 1-H-TETRAZOLE DERIVATIVE CBR1, RIF1, CBR3 F2 1565/4885PRSS1 4085/4885PRSS2 4089/4885
US-20100292483-A1 TETRAZOYLOXIME DERIVATIVE AND PLANT DISEASE CONTROL AGENT H1-3, H1-2, H1-4 F2 336/4885PRSS1 4241/4885PRSS2 2860/4885
US-20090259046-A1 Cyclic Amine Compounds and Agents for Pest Control NPR1, CYCS, CYC1 F2 261/4885PRSS1 2092/4885PRSS2 3235/4885
US-20100137594-A1 TETRAZOYLOXIME DERIVATIVE AND PLANT DISEASE CONTROL AGENT PAOX, H1-10, HAX1 F2 356/4885PRSS1 4151/4885PRSS2 3546/4885
US-20090318694-A1 Cross-Linked Amine Compounds and Agents for Pest Control CYCS, NPY1R, CYBB F2 204/4885PRSS1 1788/4885PRSS2 1705/4885
US-20100121054-A1 PROCESS FOR PRODUCING SUBSTITUTED METHYLAMINE COMPOUND AND TRIAZINE DERIVATIVE INMT, BHMT2, HNMT F2 4330/4885PRSS1 4240/4885PRSS2 2319/4885

“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.