SCHEMBL10990669

SCHEMBL10990669

CCOCCC(=O)NS(=O)(=O)c1ccccc1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.42
CA2 P00918 4/20 0.42
CA9 Q16790 4/20 0.42
CA12 O43570 2/20 0.42
RAPGEF3 O95398 1/20 0.41
NAMPT P43490 1/20 0.41
ALKBH2 Q6NS38 1/20 0.41
ALKBH3 Q96Q83 1/20 0.41
AKR1C3 P42330 2/20 0.41
AKR1C2 P52895 2/20 0.41
FBP1 P09467 1/20 0.40
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
MMP8 P22894 1/20 0.40
MMP13 P45452 1/20 0.40
HIF1A Q16665 1/20 0.40
SLC1A3 P43003 1/20 0.40
SLC1A2 P43004 1/20 0.40
SLC1A1 P43005 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
SCHEMBL10994007 0.86 CA1 (0.47) CA1CA2CA9CA12RAPGEF3
SCHEMBL6279917 0.80 SLC1A3 (0.50) CA1CA2CA9CA12ALKBH2
SCHEMBL10985683 0.80 CA1 (0.46) CA1CA2CA9CA12RAPGEF3
SCHEMBL11851628 0.78 GAA (0.49) CA1CA2CA9CA12ALKBH2
SCHEMBL28398115 0.77 CA1 (0.49) CA1CA2CA9CA12RAPGEF3
SCHEMBL27367514 0.76 CA1 (0.50) CA1CA2CA9CA12RAPGEF3
SCHEMBL9308047 0.74 GAA (0.56) CA9CA12SMN1; SMN2
SCHEMBL3206422 0.73 SLC1A3 (0.55) CA1CA2CA9CA12ALKBH2
SCHEMBL13329854 0.72 CA1 (0.50) CA1CA2CA9CA12ALKBH2
SCHEMBL11400150 0.72 SLC1A3 (0.43) CA1CA2CA9CA12ALKBH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4495365-A N-Acylsulfonamide herbicidal antidotes STAUFFER CHEMICAL CO. (US) 1985-01-22 US disclosed
US-4347380-A N-Acylsulfonamide herbicidal antidotes STAUFFER CHEMICAL COMPANY (US) 1982-08-31 US disclosed