SCHEMBL9503197

SCHEMBL9503197

N=C(NO)NS(=O)(=O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.57
MMP2 P08253 2/20 0.57
CA1 P00915 1/20 0.57
MMP1 P03956 1/20 0.57
MMP9 P14780 1/20 0.57
MMP8 P22894 1/20 0.57
MMP13 P45452 1/20 0.57
PTGS2 P35354 3/20 0.49
PTGS1 P23219 2/20 0.49
KDM4E B2RXH2 2/20 0.47
EGFR P00533 2/20 0.46
ERBB2 P04626 1/20 0.46
P4HTM Q9NXG6 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
LMNA P02545 1/20 0.46
FLT1 P17948 1/20 0.46
FLT4 P35916 1/20 0.46
KDR P35968 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL14058721 0.79 CA2 (0.47) CA2MMP2CA1MMP1MMP9
SCHEMBL1269819 0.78 CA2 (0.54) CA2MMP2CA1MMP1MMP9
SCHEMBL9506422 0.78 CA2 (0.54) CA2MMP2CA1MMP1MMP9
SCHEMBL174174 0.77 KEAP1 (0.56) KDM4EKMT2ALMNAL3MBTL1CA12
SCHEMBL21780200 0.75 KDM4E (0.46) CA2MMP2CA1MMP1MMP9
SCHEMBL2172235 0.75 CA2 (0.61) CA2MMP2CA1MMP1MMP9
SCHEMBL10931933 0.74 CA2 (0.60) CA2MMP2CA1MMP1MMP9
SCHEMBL6012074 0.74 CA2 (0.60) CA2MMP2CA1MMP1MMP9
SCHEMBL453442 0.74 CA2 (0.60) CA2MMP2CA1MMP1MMP9
SCHEMBL5931288 0.73 FLT1 (0.71) CA2MMP2CA1MMP1MMP9

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
JP-5001024-A None JP disclosed
JP-H051024-A SULFONAMIDE DERIVATIVE TOSOH CORP 1993-01-08 JP disclosed