SCHEMBL9080332

SCHEMBL9080332

CCc1c(NC(=O)C=O)c2c(O)cccn2c1Cc1ccccc1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 4/20 0.52
PLA2G1B P04054 17/20 0.51
PLA2G2E Q9NZK7 3/20 0.51
PLA2G5 P39877 2/20 0.51
PLA2G2F Q9BZM2 1/20 0.44
PLA2G10 O15496 1/20 0.43

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
SCHEMBL8080011 0.86 PLA2G1B (0.68) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL9081139 0.85 PLA2G1B (0.45) PLA2G2APLA2G1BPLA2G2EPLA2G5
SCHEMBL9081766 0.85 PLA2G1B (0.52) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G10
SCHEMBL9082200 0.84 PLA2G1B (0.62) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL9080324 0.84 PLA2G1B (0.50) PLA2G2APLA2G1BPLA2G2EPLA2G5
SCHEMBL8028750 0.84 PLA2G1B (0.71) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL8029834 0.82 PLA2G1B (0.62) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL7012767 0.79 PLA2G2A (0.76) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL9081699 0.76 PLA2G1B (0.49) PLA2G2APLA2G1B
SCHEMBL9080609 0.75 PLA2G1B (0.47) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G10

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-1996003383-A1 INDOLIZINE sPLA2 INHIBITORS ELI LILLY AND COMPANY (US) 1996-02-08 WO disclosed