SCHEMBL7869987

SCHEMBL7869987

CC(C)(C)OC(=O)CCS(=O)(=O)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.57
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA4 P22748 1/20 0.50
CA5A P35218 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA5B Q9Y2D0 1/20 0.50
FFAR1 O14842 5/20 0.48
KMT2A Q03164 1/20 0.47
MAOB P27338 1/20 0.47
LTA4H P09960 1/20 0.47
ADAMTS4 O75173 2/20 0.46
MMP13 P45452 2/20 0.46
MMP1 P03956 1/20 0.46
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
MMP14 P50281 1/20 0.46
ADAM17 P78536 1/20 0.46

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
SCHEMBL7867066 0.83 FFAR1 (0.61) LMNACA12CA1CA2CA4
SCHEMBL7866998 0.81 LMNA (0.48) LMNACA12CA1CA2CA9
SCHEMBL5892649 0.80 MMP2 (0.67) ADAMTS4MMP13MMP1MMP2MMP9
SCHEMBL5947113 0.77 FFAR1 (0.66) FFAR1FFAR4
SCHEMBL7869912 0.77 HTT (0.57) LMNAKMT2AMMP13MMP1HTT
SCHEMBL7874020 0.77 MEN1 (0.58) LMNAFFAR1KMT2AMAOBLTA4H
SCHEMBL7017241 0.76 KMT2A (0.54) LMNAKMT2AMMP2HTTPOLB
SCHEMBL7874061 0.76 ALDH1A1 (0.58) LMNAKMT2AMMP1HTTNPSR1
SCHEMBL4062398 0.76 MAOB (0.56) LMNAFFAR1KMT2AMAOBLTA4H
SCHEMBL27562384 0.76 MAOB (0.54) LMNACA12CA1CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6300514-B1 INHIBITING MATRIX METALLOPROTEINASES ONO PHARMACEUTICAL CO., LTD. (JP) 2001-10-09 US claimed
EP-0994104-A1 ARYL (SULFIDE, SULFOXIDE AND SULFONE) DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2000-04-19 EP claimed
US-6300514-B1 INHIBITING MATRIX METALLOPROTEINASES ONO PHARMACEUTICAL CO., LTD. (JP) 2001-10-09 US disclosed
EP-0994104-A1 ARYL (SULFIDE, SULFOXIDE AND SULFONE) DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2000-04-19 EP disclosed