SCHEMBL18045083

SCHEMBL18045083

Cc1cc(C)c(S(=O)(=O)O)c(C)c1[C]c1c(C)cc(C)c(S(=O)(=O)O)c1C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP9 P14780 1/20 0.34
MMP8 P22894 1/20 0.34
MMP13 P45452 1/20 0.34
RAPGEF4 Q8WZA2 3/20 0.33
FABP4 P15090 2/20 0.33
FABP3 P05413 1/20 0.33
FABP5 Q01469 1/20 0.33
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
F2 P00734 1/20 0.32
PRSS1 P07477 1/20 0.32
PRSS2 P07478 1/20 0.32
PRSS3 P35030 1/20 0.32
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL2869064 0.83 CA1 (0.41) CA1CA2MMP1MMP2MMP9
SCHEMBL83875 0.79 LMNA (0.39) CA1CA2MMP1MMP2MMP9
Ammonia Solution, Strong SCHEMBL27721988 0.77 LMNA (0.38) CA1CA2MMP1MMP2MMP9
SCHEMBL11806586 0.75 BRD4 (0.41) CA1CA2MMP1MMP2MMP9
SCHEMBL8627896 0.73 RAPGEF4 (0.38) CA1CA2MMP1MMP2MMP9
SCHEMBL9167282 0.73 CA1 (0.35) CA1CA2MMP1MMP2MMP9
SCHEMBL2864849 0.73 LMNA (0.46) CA1CA2MMP1MMP2MMP9
SCHEMBL14991531 0.72 PGK1 (0.38) CA1CA2MMP1MMP2MMP9
SCHEMBL14990980 0.72 PGK1 (0.38) CA1CA2MMP1MMP2MMP9
SCHEMBL11081940 0.72 LMNA (0.44) CA1CA2MMP1MMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160268063-A1 ELECTRIC STORAGE DEVICE TAIYO YUDEN CO., LTD. (JP) 2016-09-15 US claimed
US-10115535-B2 Electric storage device TAIYO YUDEN CO., LTD. (JP) 2018-10-30 US disclosed
US-20160268063-A1 ELECTRIC STORAGE DEVICE TAIYO YUDEN CO., LTD. (JP) 2016-09-15 US disclosed