SCHEMBL9517338

SCHEMBL9517338

COc1cc(OC)nc(NC(=O)NS(=O)(=O)c2c(Cl)nc3sccn23)n1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.50
HTR6 P50406 9/20 0.47
ACLY P53396 1/20 0.44
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42
CCKBR P32239 1/20 0.41
CDK1 P06493 1/20 0.41
CYP1A2 P05177 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
SCHEMBL9362909 0.88 GAA (0.51) GAAHTR6KDM4EHPGDCDK1
SCHEMBL9517199 0.85 GAA (0.47) GAAHTR6KDM4EHPGDCDK1
SCHEMBL55236 0.80 GAA (0.52) GAAKDM4EHPGDCDK1CYP1A2
SCHEMBL8535700 0.80 GAA (0.52) GAAKDM4EHPGDCDK1CYP1A2
SCHEMBL9357219 0.80 GAA (0.48) GAAKDM4ECDK1CYP1A2
SCHEMBL3498696 0.78 GAA (0.51) GAAKDM4EHPGDCDK1CYP1A2
SCHEMBL9367810 0.77 GAA (0.53) GAACDK1CYP1A2
SCHEMBL9362781 0.75 GAA (0.46) GAACDK1
SCHEMBL12633039 0.75 GAA (0.46) GAAKDM4ECDK1
SCHEMBL10754162 0.75 GAA (0.58) GAAKDM4ECDK1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0238070-B1 Sulfonylurea compounds, their production and herbicidal use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1993-12-29 EP claimed
US-5017212-A For rice paddies TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1991-05-21 US claimed
EP-0238070-A2 Sulfonylurea compounds, their production and herbicidal use Takeda Chemical Industries, Ltd. (JP) 1987-09-23 EP claimed