SCHEMBL4760574

SCHEMBL4760574

Cc1ccc(S(=O)(=O)O[I]O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.52
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
MMP1 P03956 1/20 0.48
MMP2 P08253 1/20 0.48
MMP9 P14780 1/20 0.48
MMP8 P22894 1/20 0.48
MMP13 P45452 1/20 0.48
CA12 O43570 1/20 0.48
CA3 P07451 1/20 0.48
CA6 P23280 1/20 0.48
CA5A P35218 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA5B Q9Y2D0 1/20 0.48
TLR9 Q9NR96 1/20 0.46
VDR P11473 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45

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
SCHEMBL2027 0.79 GAA (0.54) GAACA1CA2MMP1MMP2
SCHEMBL6490 0.78 GAA (0.59) GAACA1CA2MMP1MMP2
SCHEMBL7186972 0.78 GAA (0.59) GAACA1CA2MMP1MMP2
Water SCHEMBL3352692 0.76 GAA (0.56) GAACA1CA2MMP1MMP2
SCHEMBL9901122 0.76 GAA (0.56) GAACA1CA2MMP1MMP2
SCHEMBL30862469 0.76 GAA (0.56) GAACA1CA2MMP1MMP2
SCHEMBL15256448 0.76 GAA (0.56) GAACA1CA2MMP1MMP2
SCHEMBL27524 0.76 GAA (0.56) GAACA1CA2MMP1MMP2
SCHEMBL526315 0.76 GAA (0.50) GAACA1CA2MMP1MMP2
SCHEMBL10637725 0.76 ALDH1A1 (0.60) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2008063314-A ENVIRONMENT-CONSCIOUS HYPERVALENT IODINE REAGENT TOKYO KASEI KOGYO KK 2008-03-21 JP disclosed
US-4450360-A PHOTOINITIATORS AND PROMOTERS FOR CURING EPOXY RESINS AND EPOXIDIZED NOVOLAKS GENERAL ELECTRIC COMPANY (US) 1984-05-22 US disclosed