SCHEMBL7637211

SCHEMBL7637211

CC(=O)Nc1ccc(C(=O)N(C)C)c(S(N)(=O)=O)c1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.50
CA1 P00915 5/20 0.50
CA9 Q16790 5/20 0.50
CA12 O43570 4/20 0.50
CDK1 P06493 1/20 0.46
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
POLB P06746 1/20 0.44
ENPP2 Q13822 1/20 0.44
AMY1A P0DUB6 1/20 0.42
ATAD2 Q6PL18 1/20 0.42
CECR2 Q9BXF3 1/20 0.42
IDO1 P14902 1/20 0.42

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
SCHEMBL7686850 0.86 CDK1 (0.43) CA2CA1CA9CA12CDK1
SCHEMBL7632558 0.85 POLB (0.48) CA2CA1CA9CA12CDK1
SCHEMBL7683635 0.85 CA1 (0.54) CA2CA1CA9CA12ALDH1A1
SCHEMBL7628690 0.82 CDK1 (0.54) CA2CA1CA9CA12CDK1
SCHEMBL22843944 0.79 ALDH1A1 (0.61) CA2CA1CA9CA12ALDH1A1
SCHEMBL6104098 0.79 ALDH1A1 (0.42) CA2CA1CA9CA12ALDH1A1
SCHEMBL7924846 0.75 CA2 (0.43) CA2CA1CA9CA12ALDH1A1
SCHEMBL7636571 0.74 KDM4E (0.49) CA2CA1CA9CA12ALDH1A1
SCHEMBL6192129 0.74 ALDH1A1 (0.73) CA2CA1CA9CA12CDK1
SCHEMBL1522635 0.74 CA2 (0.57) CA2CA1CA9CA12CDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6486096-B1 Herbicidal compositions with acylated aminophenylsulfonylureas HOECHST SCHERING AGREVO GMBH (DE) 2002-11-26 US disclosed