SCHEMBL17979652

SCHEMBL17979652

CCCC1OC(=O)C1CCCc1ccccc1

nearest known ligand 0.91

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PLA2G6 O60733 2/20 0.91
PLA2G4A P47712 1/20 0.91
FASN P49327 1/20 0.59
LYPLA1 O75608 2/20 0.47
LYPLA2 O95372 2/20 0.47
ABHD16A O95870 1/20 0.47
CTRB1 P17538 1/20 0.45
DAGLA Q9Y4D2 3/20 0.43
NAAA Q02083 3/20 0.43
SOAT1 P35610 1/20 0.39

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
SCHEMBL17979639 0.95 PLA2G6 (1.00) PLA2G6PLA2G4AFASNLYPLA1LYPLA2
SCHEMBL17979630 0.90 PLA2G6 (0.80) PLA2G6PLA2G4AFASNLYPLA1LYPLA2
SCHEMBL19514904 0.87 PLA2G6 (0.84) PLA2G6PLA2G4AFASNLYPLA1LYPLA2
SCHEMBL17760808 0.87 PLA2G6 (0.84) PLA2G6PLA2G4AFASNLYPLA1LYPLA2
SCHEMBL17760804 0.87 PLA2G6 (0.84) PLA2G6PLA2G4AFASNLYPLA1LYPLA2
SCHEMBL19514903 0.87 PLA2G6 (0.84) PLA2G6PLA2G4AFASNLYPLA1LYPLA2
SCHEMBL19514898 0.87 PLA2G6 (0.84) PLA2G6PLA2G4AFASNLYPLA1LYPLA2
SCHEMBL19514935 0.87 PLA2G6 (0.84) PLA2G6PLA2G4AFASNLYPLA1LYPLA2
SCHEMBL19514905 0.87 PLA2G6 (0.84) PLA2G6PLA2G4AFASNLYPLA1LYPLA2
SCHEMBL19514899 0.87 PLA2G6 (0.84) PLA2G6PLA2G4AFASNLYPLA1LYPLA2

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
WO-2016128131-A1 BETA-LACTONE INHIBITORS OF PHOSPHOLIPASE A2 AND USES THEREOF NATIONAL AND KAPODISTRIAN UNIVERSITY OF ATHENS (GR) 2016-08-18 WO claimed
WO-2016128131-A1 BETA-LACTONE INHIBITORS OF PHOSPHOLIPASE A2 AND USES THEREOF NATIONAL AND KAPODISTRIAN UNIVERSITY OF ATHENS (GR) 2016-08-18 WO disclosed
WO-2016128131-A1 BETA-LACTONE INHIBITORS OF PHOSPHOLIPASE A2 AND USES THEREOF NATIONAL AND KAPODISTRIAN UNIVERSITY OF ATHENS (GR) 2016-08-18 WO disclosed