SCHEMBL8828126

SCHEMBL8828126

CC(C)(C)OC(=O)C[C@@H](CCCCO)C(=O)N1C(=O)OC[C@@H]1Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.40
PLA2G10 O15496 1/20 0.36
PLA2G5 P39877 1/20 0.36
NAAA Q02083 1/20 0.36
KLK7 P49862 6/20 0.36
KLK5 Q9Y337 5/20 0.36
USP2 O75604 3/20 0.35
PRSS1 P07477 2/20 0.35
PRSS2 P07478 2/20 0.35
PRSS3 P35030 2/20 0.35
IL6ST P40189 1/20 0.35
FAAH O00519 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
NR1H2 P55055 2/20 0.34
NR1H3 Q13133 2/20 0.34
CSNK2B P67870 1/20 0.33
CSNK2A1 P68400 1/20 0.33

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
SCHEMBL14296459 0.94 PPARA (0.39) PPARAPLA2G10PLA2G5NAAAKLK7
SCHEMBL17756172 0.94 PPARA (0.39) PPARAPLA2G10PLA2G5NAAAKLK7
SCHEMBL8011986 0.94 PPARA (0.39) PPARAPLA2G10PLA2G5NAAAKLK7
SCHEMBL974301 0.93 KLK7 (0.43) PPARAPLA2G10PLA2G5NAAAKLK7
SCHEMBL6448978 0.93 KLK7 (0.43) PPARAPLA2G10PLA2G5NAAAKLK7
SCHEMBL6448977 0.93 KLK7 (0.43) PPARAPLA2G10PLA2G5NAAAKLK7
SCHEMBL2025733 0.93 KLK7 (0.43) PPARAPLA2G10PLA2G5NAAAKLK7
SCHEMBL7081418 0.92 PPARA (0.46) PPARAPLA2G10PLA2G5NAAAKLK7
SCHEMBL7081422 0.92 PPARA (0.46) PPARAPLA2G10PLA2G5NAAAKLK7
SCHEMBL7081419 0.92 PPARA (0.46) PPARAPLA2G10PLA2G5NAAAKLK7

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5618844-A MATRIX METALLOPROTEINASE INHIBITOR SANOFI S.A. (FR) 1997-04-08 US disclosed
US-5514716-A MATRIX METALLOPROTEINASE INHIBITORS, ANTIARTHRITIC STERLING WINTHROP, INC. (US) 1996-05-07 US disclosed