SCHEMBL9539647

SCHEMBL9539647

Nc1ccccc1-c1ccccc1.O=C(O)[C@H](Cc1ccccc1)NS(=O)(=O)c1ccc(F)cc1

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 13/20 0.66
MMP9 P14780 11/20 0.66
ADAMTS4 O75173 1/20 0.66
MMP1 P03956 2/20 0.60
MMP3 P08254 2/20 0.60
MMP13 P45452 2/20 0.60
ADAMTS5 Q9UNA0 1/20 0.60
MMP7 P09237 1/20 0.60
ALDH1A1 P00352 1/20 0.57
MAPT P10636 1/20 0.57
POLB P06746 1/20 0.54
CTSL P07711 1/20 0.52
CTSS P25774 1/20 0.52
CTSK P43235 1/20 0.52
MMP8 P22894 1/20 0.52
MMP12 P39900 1/20 0.52
MMP14 P50281 1/20 0.52
TP53 P04637 1/20 0.50

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
SCHEMBL7468716 0.88 MMP2 (0.79) MMP2MMP9ADAMTS4MMP1MMP3
SCHEMBL5189189 0.88 MMP2 (0.79) MMP2MMP9ADAMTS4MMP1MMP3
SCHEMBL7460419 0.88 MMP2 (0.79) MMP2MMP9ADAMTS4MMP1MMP3
SCHEMBL8914953 0.87 MMP2 (0.63) MMP2MMP9ADAMTS4MMP1MMP3
SCHEMBL9540905 0.83 ADAMTS4 (0.64) MMP2MMP9ADAMTS4MMP1MMP3
SCHEMBL32691761 0.80 MMP2 (1.00) MMP2MMP9ADAMTS4MMP1MMP3
SCHEMBL6545297 0.80 MMP2 (1.00) MMP2MMP9ADAMTS4MMP1MMP3
SCHEMBL1920507 0.80 MMP2 (1.00) MMP2MMP9ADAMTS4MMP1MMP3
SCHEMBL14218257 0.80 MMP2 (0.87) MMP2MMP9ADAMTS4MMP1MMP3
SCHEMBL4188026 0.79 MMP2 (0.85) MMP2MMP9ADAMTS4MMP1MMP3

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
WO-1993005014-A1 AROMATIC SULFONAMIDE DERIVATIVES, THEIR USE AS ENZYME INHIBITORS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PHARNO-WEDROPHARM GMBH (DE) 1993-03-18 WO disclosed