SCHEMBL9531300

SCHEMBL9531300

CCOC(=O)c1ccc(NN2C(=O)C(C)=C(C)[NH+]2[O-])cc1S(N)(=O)=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 11/20 0.39
CA2 P00918 11/20 0.39
CA12 O43570 8/20 0.39
CA9 Q16790 8/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 2/20 0.37
CA5A P35218 2/20 0.36
CA7 P43166 2/20 0.36
CA4 P22748 1/20 0.36
CA5B Q9Y2D0 1/20 0.36
CA14 Q9ULX7 1/20 0.35
CHRNA7 P36544 6/20 0.35
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL9530201 0.82 CA1 (0.44) CA1CA2CA12CA9MEN1
SCHEMBL9532475 0.77 CA1 (0.39) CA1CA2CA12CA9MEN1
SCHEMBL9530711 0.75 CA1 (0.50) CA1CA2CA12CA9MEN1
SCHEMBL8539079 0.72 CA1 (0.47) CA1CA2CA12CA9MEN1
SCHEMBL9738324 0.72 CA2 (0.49) CA1CA2CA12CA9CA5A
SCHEMBL9531877 0.70 CA1 (0.55) CA1CA2CA12CA9MEN1
SCHEMBL28090844 0.68 CA1 (0.52) CA1CA2CA12CA9MEN1
SCHEMBL28732676 0.67 CA2 (0.51) CA1CA2CA12CA9MEN1
SCHEMBL9530660 0.67 ALDH1A1 (0.40) CA1CA2CA12CA9MEN1
SCHEMBL30748712 0.65 CA1 (0.68) CA1CA2CA12CA9KMT2A

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
EP-0384602-B1 N-substituted-3-[(2,3-dimethylmaleimido) amino]-benzenesulfonamide derivatives, preparation process thereof and herbicidal compositions KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1993-08-04 EP disclosed
US-5028255-A N-substituted-3-[(2,3-dimethylmaleimido)amino)]-benzenesulfonamide derivatives, hebicidal compositions and method of use KUREHA KAGAKU KOGYO K.K. (JP) 1991-07-02 US disclosed