SCHEMBL6422563

SCHEMBL6422563

C#CCS(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.53
MMP13 P45452 7/20 0.53
MMP8 P22894 2/20 0.53
HTT P42858 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
MMP1 P03956 5/20 0.50
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
MMP9 P14780 2/20 0.48
HSD11B1 P28845 1/20 0.47
ALDH1A1 P00352 2/20 0.46
GAA P10253 2/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
MMP2 P08253 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
SCHEMBL4071220 0.81 PKM (0.54) PKMMMP13MMP8HTTNPSR1
SCHEMBL6424729 0.79 MMP13 (0.50) PKMMMP13MMP8HTTNPSR1
SCHEMBL11964589 0.79 ALDH1A1 (0.55) PKMMEN1KMT2AHSD11B1ALDH1A1
SCHEMBL6708168 0.78 PKM (0.64) PKMMMP13MMP8HTTNPSR1
SCHEMBL3250372 0.78 PKM (0.64) PKMMMP13MMP8HTTNPSR1
SCHEMBL11017416 0.76 ALDH1A1 (0.50) MMP13MMP8MMP1MEN1KMT2A
SCHEMBL9705169 0.76 PKM (0.61) PKMMMP13MMP8HTTNPSR1
SCHEMBL3369176 0.75 ALDH1A1 (0.65) PKMMMP13MMP8MMP1MMP9
SCHEMBL14468640 0.75 PKM (0.59) PKMMMP13MMP8HTTNPSR1
SCHEMBL2522787 0.75 GAA (0.55) PKMMMP13MMP8HTTMMP1

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
EP-0929519-B1 BETA-SULFONYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASES INHIBITORS UPJOHN CO (US) 2005-02-23 EP claimed