SCHEMBL8840147

SCHEMBL8840147

CC(C)C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 7/20 0.69
MMP9 P14780 4/20 0.69
MMP1 P03956 2/20 0.69
MMP3 P08254 2/20 0.69
MMP7 P09237 2/20 0.69
MMP13 P45452 2/20 0.69
ADAMTS5 Q9UNA0 1/20 0.60
KDM4E B2RXH2 2/20 0.60
MEN1 O00255 1/20 0.55
CYP2C9 P11712 1/20 0.55
KMT2A Q03164 1/20 0.55
ALDH1A1 P00352 2/20 0.54
CYP2C19 P33261 1/20 0.54
SLC1A3 P43003 1/20 0.54
SLC1A2 P43004 1/20 0.54
SLC1A1 P43005 1/20 0.54
LMNA P02545 1/20 0.52
GRN P28799 1/20 0.50
SORT1 Q99523 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
SCHEMBL7062306 1.00 MMP2 (0.69) MMP2MMP9MMP1MMP3MMP7
SCHEMBL7066879 0.88 MMP2 (0.69) MMP2MMP9MMP1MMP3MMP7
SCHEMBL1871538 0.87 MMP2 (0.53) MMP2MMP9MMP1MMP3MMP7
SCHEMBL1879215 0.87 MMP2 (0.53) MMP2MMP9MMP1MMP3MMP7
SCHEMBL11351046 0.87 MMP9 (0.71) MMP2MMP9MMP1MMP3MMP7
SCHEMBL7066619 0.87 MMP9 (0.71) MMP2MMP9MMP1MMP3MMP7
SCHEMBL3969625 0.87 MMP9 (0.71) MMP2MMP9MMP1MMP3MMP7
SCHEMBL6561338 0.86 MMP2 (0.70) MMP2MMP9MMP1MMP3MMP7
SCHEMBL5191083 0.86 MMP2 (0.70) MMP2MMP9MMP1MMP3MMP7
SCHEMBL15251807 0.86 MMP2 (0.70) MMP2MMP9MMP1MMP3MMP7

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
US-5650428-A THROMBOXANE A2 ANTAGONISM NKK CORPORATION (JP) 1997-07-22 US disclosed