SCHEMBL1869173

SCHEMBL1869173

COc1nc(C)nc(NC(=O)NS(=O)(=O)c2ccccc2OC(C)C(F)(F)F)n1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
KDM4E B2RXH2 2/20 0.40
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.39
FFAR2 O15552 1/20 0.36
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
SLC6A9 P48067 1/20 0.34
KCNH2 Q12809 1/20 0.34
CDK1 P06493 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL10383467 0.88 MAPT (0.43) MAPTKDM4ENPC1ALDH1A1GAA
SCHEMBL10692208 0.86 MAPT (0.43) MAPTKDM4ENPC1ALDH1A1GAA
SCHEMBL1874504 0.86 GAA (0.38) MAPTKDM4ENPC1ALDH1A1GAA
SCHEMBL2994281 0.86 KDM4E (0.47) MAPTKDM4ENPC1ALDH1A1GAA
SCHEMBL11000660 0.86 MAPT (0.42) MAPTKDM4ENPC1ALDH1A1GAA
SCHEMBL1111483 0.85 ALDH1A1 (0.45) MAPTKDM4ENPC1ALDH1A1GAA
SCHEMBL11112932 0.85 ALDH1A1 (0.41) MAPTKDM4ENPC1ALDH1A1GAA
SCHEMBL10915190 0.85 MAPT (0.42) MAPTKDM4ENPC1ALDH1A1GAA
SCHEMBL10383472 0.84 MAPT (0.46) MAPTKDM4ENPC1ALDH1A1GAA
SCHEMBL9419235 0.83 ALDH1A1 (0.44) MAPTKDM4ENPC1ALDH1A1GAA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110105324-A1 Herbicidal Compounds Based on N-Azinyl-N-Phenylsulfonylureas BAYER CROPSCIENCE AG (DE) 2011-05-05 US disclosed
US-20110105324-A1 Herbicidal Compounds Based on N-Azinyl-N-Phenylsulfonylureas BAYER CROPSCIENCE AG (DE) 2011-05-05 US disclosed
WO-2009127378-A1 HERBICIDAL COMPOUNDS BASED ON N-AZINYL-N'-PHENYLSULFONYLUREAS BAYER CROPSCIENCE AG (DE) 2009-10-22 WO disclosed
EP-2110019-A1 Herbicidal compounds based on N-Azinyl-N'-phenylsulfonylureas Bayer CropScience AG (DE) 2009-10-21 EP disclosed
EP-2110019-A1 Herbicidal compounds based on N-Azinyl-N'-phenylsulfonylureas Bayer CropScience AG (DE) 2009-10-21 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 (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-20110105324-A1 Herbicidal Compounds Based on N-Azinyl-N-Phenylsulfonylureas DDT, AZI2, PFAS MAPT 4530/4885KDM4E 332/4885NPC1 4376/4885

“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.