SCHEMBL7389205

SCHEMBL7389205

COc1ccc(-c2ccc(S(=O)(=O)CCOc3ccc4ccccc4c3C(=O)NO)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 15/20 1.00
MMP1 P03956 3/20 0.46
MMP9 P14780 3/20 0.46
MMP2 P08253 2/20 0.46
MMP8 P22894 2/20 0.46
MMP12 P39900 2/20 0.46
MMP13 P45452 2/20 0.46
MMP14 P50281 2/20 0.46
MMP16 P51512 2/20 0.46
GAA P10253 1/20 0.42
MEP1B Q16820 1/20 0.41

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
SCHEMBL7398298 0.88 MMP3 (1.00) MMP3MMP1MMP9MMP2MMP13
SCHEMBL7397190 0.82 MMP3 (1.00) MMP3MMP1MMP9MMP2MMP8
SCHEMBL7997116 0.82 MMP3 (0.69) MMP3MMP9MMP2MMP12MMP14
SCHEMBL7392568 0.80 MMP3 (1.00) MMP3
SCHEMBL7990560 0.76 MMP3 (0.79) MMP3MMP1MMP9MMP2MMP13
SCHEMBL7979268 0.74 MMP3 (1.00) MMP3MMP1MMP9MMP2MMP8
SCHEMBL7993608 0.74 MMP3 (0.94) MMP3MMP1MMP9MMP2MMP13
SCHEMBL7997139 0.73 MMP3 (0.72) MMP3
SCHEMBL11841026 0.73 MMP3 (0.55) MMP3
SCHEMBL7993523 0.71 MMP3 (0.70) MMP3MMP9MMP2GAA

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-6288261-B1 DRUGS FOR INHIBITION OF ENZYMES ABBOTT LABORATORIES 2001-09-11 US claimed
WO-2000037433-A1 INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 2000-06-29 WO claimed
US-6288261-B1 DRUGS FOR INHIBITION OF ENZYMES ABBOTT LABORATORIES 2001-09-11 US disclosed