SCHEMBL8615510

SCHEMBL8615510

CCOC(=O)c1c(CC)c(C(=O)c2ccccc2-c2ccccc2)n2cccc(OCc3ccccc3)c12

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 17/20 0.50
PLA2G2A P14555 4/20 0.45
PLA2G2E Q9NZK7 3/20 0.45
PLA2G5 P39877 2/20 0.45
PLA2G10 O15496 1/20 0.41

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
SCHEMBL7007210 0.91 PLA2G1B (0.53) PLA2G1BPLA2G2APLA2G2EPLA2G5
SCHEMBL7012444 0.87 PLA2G1B (0.46) PLA2G1BPLA2G2APLA2G2EPLA2G5
SCHEMBL7014374 0.83 PLA2G1B (0.57) PLA2G1BPLA2G2APLA2G2EPLA2G5
SCHEMBL8615512 0.78 PLA2G1B (0.43) PLA2G1BPLA2G2APLA2G2EPLA2G5
SCHEMBL7013840 0.77 PLA2G1B (0.47) PLA2G1BPLA2G2APLA2G2EPLA2G5
SCHEMBL7013388 0.77 PLA2G1B (0.48) PLA2G1BPLA2G2A
SCHEMBL7012614 0.77 PLA2G1B (0.48) PLA2G1BPLA2G2APLA2G2EPLA2G5
SCHEMBL8318865 0.76 PLA2G1B (0.48) PLA2G1BPLA2G2APLA2G2EPLA2G5PLA2G10
Butane SCHEMBL7011259 0.76 PLA2G1B (0.41) PLA2G1B
SCHEMBL7013764 0.72 PLA2G1B (0.58) PLA2G1BPLA2G2APLA2G2EPLA2G5

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-1998047507-A1 METHOD FOR THE TREATMENT OF STROKE USING N-HETEROCYCLIC GLYOXYLAMIDE COMPOUNDS SHIONOGI & CO., LTD. (JP) 1998-10-29 WO disclosed