SCHEMBL8081096

SCHEMBL8081096

CCOC(=O)COc1cccn2c(Cc3cccc4ccccc34)c(CC)c(NC(=O)C=O)c12

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 17/20 0.58
PLA2G2A P14555 3/20 0.57
PLA2G2E Q9NZK7 2/20 0.42
PLA2G5 P39877 1/20 0.42

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
SCHEMBL8084309 0.91 PLA2G1B (0.69) PLA2G1BPLA2G2APLA2G2EPLA2G5
SCHEMBL8029834 0.87 PLA2G1B (0.62) PLA2G1BPLA2G2APLA2G2EPLA2G5
SCHEMBL9081427 0.86 PLA2G1B (0.57) PLA2G1BPLA2G2APLA2G2EPLA2G5
SCHEMBL8026001 0.86 PLA2G1B (0.54) PLA2G1BPLA2G2APLA2G2EPLA2G5
SCHEMBL9081694 0.86 PLA2G1B (0.54) PLA2G1BPLA2G2APLA2G2EPLA2G5
SCHEMBL9080324 0.82 PLA2G1B (0.50) PLA2G1BPLA2G2APLA2G2EPLA2G5
SCHEMBL8026443 0.82 PLA2G1B (0.57) PLA2G1BPLA2G2A
SCHEMBL7051145 0.81 PLA2G1B (0.84) PLA2G1BPLA2G2APLA2G2EPLA2G5
SCHEMBL9081279 0.81 PLA2G1B (0.49) PLA2G1BPLA2G2APLA2G2EPLA2G5
SCHEMBL8028750 0.80 PLA2G1B (0.71) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1037630-A2 METHOD FOR THE TREATMENT OF DISORDERS ASSOCIATED WITH APOPTOSIS USING N-HETEROCYCLIC GLYOXYLAMIDE COMPOUNDS SHIONOGI & CO., LTD. (JP) 2000-09-27 EP claimed
WO-1999024026-A2 METHOD FOR THE TREATMENT OF DISORDERS ASSOCIATED WITH APOPTOSIS USING N-HETEROCYCLIC GLYOXYLAMIDE COMPOUNDS SHIONOGI & CO., LTD. (JP) 1999-05-20 WO claimed
EP-1037630-A2 METHOD FOR THE TREATMENT OF DISORDERS ASSOCIATED WITH APOPTOSIS USING N-HETEROCYCLIC GLYOXYLAMIDE COMPOUNDS SHIONOGI & CO., LTD. (JP) 2000-09-27 EP disclosed
WO-1999024026-A2 METHOD FOR THE TREATMENT OF DISORDERS ASSOCIATED WITH APOPTOSIS USING N-HETEROCYCLIC GLYOXYLAMIDE COMPOUNDS SHIONOGI & CO., LTD. (JP) 1999-05-20 WO disclosed
WO-1996003383-A1 INDOLIZINE sPLA2 INHIBITORS ELI LILLY AND COMPANY (US) 1996-02-08 WO disclosed