SCHEMBL7271933

SCHEMBL7271933

CC(C)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)Cc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA5A P35218 1/20 0.42
CA9 Q16790 1/20 0.42
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
MMP8 P22894 1/20 0.39
MMP13 P45452 1/20 0.39
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 2/20 0.38
HPGD P15428 1/20 0.38
FPR1 P21462 1/20 0.38
PRSS1 P07477 3/20 0.38
PRSS2 P07478 3/20 0.38
PRSS3 P35030 3/20 0.38
FAAH O00519 1/20 0.38
ELANE P08246 1/20 0.38
PRTN3 P24158 1/20 0.38
KMT2A Q03164 4/20 0.36

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
SCHEMBL6549890 0.85 CA2 (0.52) CA1CA2CA5ACA9MMP1
SCHEMBL7757515 0.82 CA1 (0.46) CA1CA2CA5ACA9MMP1
SCHEMBL35897 0.71
SCHEMBL6930909 0.68 KMT2A (0.40) ALDH1A1HSD17B10HPGDKMT2AMEN1
SCHEMBL7594223 0.68 PRSS1 (0.52) CA1CA2CA5ACA9MMP1
SCHEMBL3252117 0.68 CA1 (0.52) CA1CA2CA5ACA9MMP1
SCHEMBL7962771 0.68 TSHR (0.43) CA1CA2CA5ACA9MMP1
SCHEMBL3241398 0.66 PRSS1 (0.50) CA1CA2CA5ACA9MMP1
SCHEMBL17221973 0.66 GAA (0.45) CA1CA2CA5ACA9ALDH1A1
SCHEMBL1457443 0.66 CA1 (0.54) CA1CA2CA5ACA9MMP1

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-6656660-B1 Resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-12-02 US disclosed
EP-1024406-A1 Resist composition WAKO PURE CHEMICAL INDUSTRIES LTD (JP) 2000-08-02 EP disclosed