SCHEMBL7874162

SCHEMBL7874162

CCCCCC#Cc1ccc(S(=O)(=O)CC(C)C(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 4/20 0.50
FFAR1 O14842 2/20 0.50
FFAR4 Q5NUL3 1/20 0.50
MMP12 P39900 1/20 0.49
MMP13 P45452 3/20 0.41
MMP3 P08254 2/20 0.41
TNK2 Q07912 1/20 0.40
GGPS1 O95749 1/20 0.38
ITGB1 P05556 1/20 0.38
ITGA4 P13612 1/20 0.38
KCNH2 Q12809 1/20 0.36
CYSLTR2 Q9NS75 1/20 0.36
CYSLTR1 Q9Y271 1/20 0.36
MMP9 P14780 1/20 0.36
PRKCG P05129 1/20 0.35
PRKCB P05771 1/20 0.35
PRKCA P17252 1/20 0.35
PRKCE Q02156 1/20 0.35
PRKCD Q05655 1/20 0.35

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
SCHEMBL7870820 0.87 MMP2 (0.45) MMP2FFAR1FFAR4MMP12MMP13
SCHEMBL7867094 0.86 MMP2 (0.45) MMP2FFAR1FFAR4MMP13MMP3
SCHEMBL7866972 0.80 FFAR1 (0.62) MMP2FFAR1FFAR4MMP12TNK2
SCHEMBL8446074 0.79 MMP2 (0.64) MMP2FFAR1FFAR4MMP12MMP13
SCHEMBL7862162 0.79 MMP9 (0.56) MMP2FFAR1MMP13MMP3MMP9
SCHEMBL8450866 0.78 MMP2 (0.62) MMP2FFAR1FFAR4MMP12MMP13
SCHEMBL7868836 0.72 MMP2 (0.47) MMP2MMP13MMP3MMP9
SCHEMBL8448589 0.72 MMP13 (0.56) MMP2FFAR1FFAR4MMP12MMP13
SCHEMBL5598328 0.72 FFAR1 (0.59) MMP2FFAR1FFAR4MMP12TNK2
SCHEMBL6937361 0.72 MMP2 (0.69) MMP2FFAR1FFAR4MMP12TNK2

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