SCHEMBL9603327

SCHEMBL9603327

CC(=O)Nc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)O)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.64
MMP1 P03956 2/20 0.64
MMP9 P14780 2/20 0.64
MMP13 P45452 2/20 0.64
MMP3 P08254 1/20 0.64
MMP7 P09237 1/20 0.64
ADAMTS4 O75173 1/20 0.61
POLB P06746 2/20 0.60
CA1 P00915 4/20 0.57
CA2 P00918 4/20 0.57
MMP8 P22894 1/20 0.57
ALDH1A1 P00352 2/20 0.56
LMNA P02545 1/20 0.56
KDM4E B2RXH2 1/20 0.56
PLAU P00749 1/20 0.55
HPN P05981 1/20 0.55
CA12 O43570 1/20 0.54
CA9 Q16790 1/20 0.54
GFER P55789 2/20 0.53
MAPT P10636 1/20 0.53

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
SCHEMBL7062840 1.00 MMP2 (0.64) MMP2MMP1MMP9MMP13MMP3
SCHEMBL15251688 1.00 MMP2 (0.64) MMP2MMP1MMP9MMP13MMP3
SCHEMBL7668182 0.85 MMP9 (0.72) MMP2MMP1MMP9MMP13MMP3
SCHEMBL7673418 0.85 MMP9 (0.72) MMP2MMP1MMP9MMP13MMP3
SCHEMBL7066619 0.83 MMP9 (0.71) MMP2MMP1MMP9MMP13MMP3
SCHEMBL3969625 0.83 MMP9 (0.71) MMP2MMP1MMP9MMP13MMP3
SCHEMBL11351046 0.83 MMP9 (0.71) MMP2MMP1MMP9MMP13MMP3
SCHEMBL7667679 0.83 MMP9 (0.72) MMP2MMP1MMP9MMP13MMP3
SCHEMBL7676199 0.83 MMP9 (0.72) MMP2MMP1MMP9MMP13MMP3
SCHEMBL5191083 0.83 MMP2 (0.70) MMP2MMP1MMP9MMP13MMP3

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-1993015047-A1 AMINO ACID DERIVATIVES AS PAF ANTAGONISTS BRITISH BIO-TECHNOLOGY LIMITED (GB) 1993-08-05 WO disclosed