SCHEMBL751686

SCHEMBL751686

COC(=O)c1nccnc1CS(=O)(=O)Cc1c(F)ccc(Cl)c1Cl

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
ACLY P53396 2/20 0.35
MAPT P10636 1/20 0.35
POLB P06746 1/20 0.35
MCOLN3 Q8TDD5 1/20 0.35
P2RX7 Q99572 1/20 0.35
MET P08581 1/20 0.34
HSP90AA1 P07900 1/20 0.33
GAA P10253 2/20 0.33
S1PR4 O95977 1/20 0.33
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
TSHR P16473 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
CYP3A4 P08684 1/20 0.32
CD38 P28907 1/20 0.32
GRM4 Q14833 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL18191253 0.83 LMNA (0.41) ALDH1A1ACLYMAPTGAALMNA
SCHEMBL270112 0.81 ACLY (0.37) ALDH1A1ACLYMAPTPOLBMCOLN3
SCHEMBL753438 0.81 ALDH1A1 (0.38) ALDH1A1P2RX7METHSP90AA1GAA
SCHEMBL271949 0.77 SCD (0.38) ALDH1A1ACLYMAPTPOLBMCOLN3
SCHEMBL271319 0.76 POLB (0.35) ALDH1A1ACLYMAPTPOLBMCOLN3
SCHEMBL271334 0.74 ACLY (0.38) ALDH1A1ACLYMAPTPOLBMCOLN3
SCHEMBL272052 0.74 SCD (0.41) ALDH1A1MAPTPOLBS1PR4TSHR
SCHEMBL271950 0.72 ACLY (0.35) ALDH1A1ACLYMAPTPOLBMCOLN3
SCHEMBL271252 0.71 CCR4 (0.38) ALDH1A1ACLYPOLBGAAS1PR4
SCHEMBL270599 0.71 ACLY (0.36) ALDH1A1ACLYMAPTPOLBMCOLN3

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-8569301-B2 6, 6-dioxo-6-thia-1, 4-diaza-naphthalenes as herbicides SYNGENTA LIMITED (GB) 2013-10-29 US disclosed
US-8569301-B2 6, 6-dioxo-6-thia-1, 4-diaza-naphthalenes as herbicides SYNGENTA LIMITED (GB) 2013-10-29 US disclosed
US-8569301-B2 6, 6-dioxo-6-thia-1, 4-diaza-naphthalenes as herbicides SYNGENTA LIMITED (GB) 2013-10-29 US disclosed
EP-2430028-B1 HERBICIDAL COMPOUNDS SYNGENTA LTD (GB) 2013-08-28 EP disclosed
EP-2430028-B1 HERBICIDAL COMPOUNDS SYNGENTA LTD (GB) 2013-08-28 EP disclosed
US-20120115726-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2012-05-10 US disclosed
US-20120115726-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2012-05-10 US disclosed
US-20120115726-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2012-05-10 US disclosed
EP-2430028-A1 HERBICIDAL COMPOUNDS Syngenta Limited (GB) 2012-03-21 EP disclosed
WO-2010130970-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2010-11-18 WO disclosed
WO-2010130970-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2010-11-18 WO 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 (1 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-20120115726-A1 HERBICIDAL COMPOUNDS DDT, NAT1, DDAH1 ALDH1A1 139/4885ACLY 761/4885MAPT 4501/4885

“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.