SCHEMBL6012074

SCHEMBL6012074

O=C(NS(=O)(=O)c1ccccc1)NS(=O)(=O)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.60
CA1 P00915 6/20 0.60
MMP1 P03956 1/20 0.60
MMP2 P08253 1/20 0.60
MMP9 P14780 1/20 0.60
MMP8 P22894 1/20 0.60
MMP13 P45452 1/20 0.60
PTGS2 P35354 3/20 0.58
PTGS1 P23219 2/20 0.58
KDM4E B2RXH2 1/20 0.58
LMNA P02545 1/20 0.58
HPGD P15428 1/20 0.56
CA9 Q16790 3/20 0.56
NLRP3 Q96P20 1/20 0.54
BCAT1 P54687 1/20 0.53
CYP2C9 P11712 1/20 0.53
CA12 O43570 1/20 0.53
IL1RN P18510 1/20 0.52
KEAP1 Q14145 1/20 0.52
ERAP1 Q9NZ08 1/20 0.52

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
SCHEMBL9182658 0.88 LMNA (0.76) CA2CA1PTGS2PTGS1KDM4E
SCHEMBL13741969 0.87 CA2 (0.52) CA2CA1MMP1MMP2MMP9
SCHEMBL27814041 0.87 CA2 (0.54) CA2CA1MMP1MMP2MMP9
SCHEMBL6535038 0.87 LMNA (0.56) CA2CA1MMP1MMP2MMP9
SCHEMBL10931933 0.86 CA2 (0.60) CA2CA1MMP1MMP2MMP9
SCHEMBL453442 0.86 CA2 (0.60) CA2CA1MMP1MMP2MMP9
SCHEMBL4196236 0.86 LMNA (0.78) CA2CA1LMNACA9NLRP3
SCHEMBL11461045 0.84 CA2 (0.58) CA2CA1MMP1MMP2MMP9
SCHEMBL8338055 0.82 GAA (0.57) CA2CA1MMP1MMP2MMP9
SCHEMBL5069150 0.82 LMNA (0.54) CA2CA1MMP1MMP2MMP9

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
CN-113474388-B Method for converting phenyl isocyanate 陶氏环球技术有限责任公司 2024-03-22 CN disclosed
US-7026477-B1 Process for preparing substituted phenylsulfonylureas from sulfonyl halides AVENTIS CROPSCIENCE GMBH (DE) 2006-04-11 US disclosed