SCHEMBL28293012

SCHEMBL28293012

Cc1ccc(S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)c2ccc(C)cc2)cc1.O=CC=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 1/20 0.42
GAA P10253 2/20 0.42
CA1 P00915 2/20 0.40
CA2 P00918 2/20 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
ALDH1A1 P00352 7/20 0.40
CA12 O43570 1/20 0.39
CA3 P07451 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA5B Q9Y2D0 1/20 0.39
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
F2 P00734 1/20 0.37

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
SCHEMBL36092 0.93 GAA (0.48) TLR9GAACA1CA2MMP1
SCHEMBL8072003 0.87 GAA (0.43) TLR9GAACA1CA2MMP1
SCHEMBL21838871 0.86 MAPT (0.47) GAACA1CA2MMP1MMP2
SCHEMBL14600187 0.86 MAPT (0.47) GAACA1CA2MMP1MMP2
SCHEMBL28254137 0.85 TLR9 (0.39) TLR9GAACA1CA2MMP1
SCHEMBL14650732 0.84 MAPT (0.48) GAACA1CA2ALDH1A1CA12
SCHEMBL60930 0.84 GAA (0.43) TLR9GAACA1CA2MMP1
SCHEMBL6105523 0.81 MAPT (0.44) GAACA1CA2ALDH1A1CA12
SCHEMBL3207137 0.81 ALDH1A1 (0.42) TLR9GAACA1CA2MMP1
SCHEMBL7688694 0.79 CA2 (0.42) GAACA1CA2MMP1MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109725493-A The primer composition being used together with photoresist 罗门哈斯电子材料韩国有限公司 2019-05-07 CN disclosed