SCHEMBL689110

SCHEMBL689110

NC(=O)NNC(=O)C(F)F

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
NFKB1 P19838 2/20 0.35
LMNA P02545 2/20 0.35
CYP1A2 P05177 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
THPO P40225 1/20 0.35
CA2 P00918 1/20 0.35
CYP3A4 P08684 1/20 0.35
CA5A P35218 1/20 0.35
BLM P54132 1/20 0.35
PMP22 Q01453 1/20 0.35
CA9 Q16790 1/20 0.35

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
SCHEMBL21785 0.73
SCHEMBL4961850 0.71 ALDH1A1 (0.39) TSHRNFKB1LMNACYP1A2MAOA
SCHEMBL6778465 0.71
SCHEMBL9487454 0.71 GAA (0.41) TSHRNFKB1LMNACYP1A2MAOA
Hydrochloric Acid SCHEMBL28172272 0.69
Urea SCHEMBL11078143 0.69 ALDH1A1 (0.60) TSHRNFKB1LMNACYP1A2MAOA
Ammonia Solution, Strong SCHEMBL28971513 0.69
SCHEMBL9056052 0.69
SCHEMBL2037276 0.69
SCHEMBL9367904 0.69 DPP4 (0.44) TSHRNFKB1LMNACYP1A2MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040167193-A1 Difluoromethyltriazolone compounds, use of the same and intermediates for the production thereof SUMITOMO CHEMICAL COMPANY, LIMITED 2004-08-26 US claimed
US-20030119670-A1 Difluoromethyltriazolone compounds, use of the same and intermediates for the production thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-06-26 US claimed
EP-1238975-A1 DIFLUOROMETHYLTRIAZOLONE COMPOUNDS, USE OF THE SAME AND INTERMEDIATES FOR THE PRODUCTION THEREOF Sumitomo Chemical Company, Limited (JP) 2002-09-11 EP claimed
EP-2268615-B1 PESTICIDES DOW AGROSCIENCES LLC (US) 2016-08-17 EP disclosed
US-8513462-B2 Pesticides and uses thereof DOW AGROSCIENCES LLC (US) 2013-08-20 US disclosed
US-8445689-B2 Pesticides DOW AGROSCIENCES, LLC. (US) 2013-05-21 US disclosed
US-20130012385-A1 PESTICIDES AND USES THEREOF DOW AGROSCIENCES LLC (US) 2013-01-10 US disclosed
US-8288589-B2 Pesticides and uses thereof DOW AGROSCIENCES, LLC (US) 2012-10-16 US disclosed
US-20120225782-A1 PESTICIDES DOW AGROSCIENCES LLC (US) 2012-09-06 US disclosed
US-8178685-B2 Pesticides DOW AGROSCIENCES, LLC (US) 2012-05-15 US disclosed
EP-2170066-B1 PESTICIDES AND USES THEREOF DOW AGROSCIENCES LLC (US) 2012-02-29 EP disclosed
EP-2170066-A2 PESTICIDES AND USES THEREOF Dow AgroSciences LLC (US) 2010-04-07 EP disclosed
WO-2009111309-A1 PESTICIDES DOW AGROSCIENCES LLC (US) 2009-09-11 WO disclosed
US-20090221424-A1 PESTICIDES DOW AGROSCIENCES LLC (US) 2009-09-03 US disclosed
WO-2009017951-A2 PESTICIDES AND USES THEREOF DOW AGROSCIENCES LLC (US) 2009-02-05 WO disclosed
US-20090029863-A1 PESTICIDES AND USES THEREOF DOW AGROSCIENCES LLC (US) 2009-01-29 US disclosed
US-20040167193-A1 Difluoromethyltriazolone compounds, use of the same and intermediates for the production thereof SUMITOMO CHEMICAL COMPANY, LIMITED 2004-08-26 US disclosed
US-6762197-B2 FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-07-13 US disclosed
US-20030119670-A1 Difluoromethyltriazolone compounds, use of the same and intermediates for the production thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-06-26 US disclosed
EP-1238975-A1 DIFLUOROMETHYLTRIAZOLONE COMPOUNDS, USE OF THE SAME AND INTERMEDIATES FOR THE PRODUCTION THEREOF Sumitomo Chemical Company, Limited (JP) 2002-09-11 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-20130012385-A1 PESTICIDES AND USES THEREOF ACHE, DDT, BCHE TSHR 1609/4885NFKB1 4046/4885LMNA 3741/4885
US-20090029863-A1 PESTICIDES AND USES THEREOF ACHE, DDT, BCHE TSHR 1609/4885NFKB1 4046/4885LMNA 3741/4885
US-20120225782-A1 PESTICIDES ACHE, DDT, GSTP1 TSHR 578/4885NFKB1 3943/4885LMNA 4044/4885
US-20090221424-A1 PESTICIDES ACHE, DDT, GSTP1 TSHR 581/4885NFKB1 3942/4885LMNA 4041/4885
US-20040167193-A1 Difluoromethyltriazolone compounds, use of the same and intermediates for the production thereof CYP51A1, DPM1, CYP1A1 TSHR 2768/4885NFKB1 3574/4885LMNA 3044/4885
US-20030119670-A1 Difluoromethyltriazolone compounds, use of the same and intermediates for the production thereof CYP51A1, DPM1, CYP1A1 TSHR 2768/4885NFKB1 3574/4885LMNA 3044/4885

“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.