SCHEMBL7948127

SCHEMBL7948127

CCc1c(C(=O)C(N)=O)c2c(C(=O)C(=O)O)nc(C)cn2c1Cc1ccccc1-c1ccc(OC)cc1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 4/20 0.58
PLA2G1B P04054 17/20 0.52
PLA2G2E Q9NZK7 3/20 0.52
PLA2G5 P39877 2/20 0.52
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
SCHEMBL7946058 0.91 PLA2G2A (0.54) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL7190951 0.87 PLA2G1B (0.59) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL7643172 0.86 PLA2G2A (0.51) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL7641251 0.85 PLA2G1B (0.58) PLA2G2APLA2G1BPLA2G2EPLA2G5
SCHEMBL7753525 0.84 PLA2G2A (0.49) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL7645569 0.83 PLA2G1B (0.55) PLA2G2APLA2G1BPLA2G2EPLA2G5
SCHEMBL7643611 0.81 PLA2G2A (0.44) PLA2G2APLA2G1BPLA2G2EPLA2G5
SCHEMBL7196785 0.79 PLA2G1B (0.67) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL7193938 0.79 PLA2G1B (0.62) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL7643276 0.78 PLA2G1B (0.43) PLA2G2APLA2G1BPLA2G2EPLA2G5

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-2001066111-A1 COMPOSITIONS CONTAINING POTENTIAL SPLA2 INHIBITORS FOR THE TREATMENT OF PAIN ELI LILLY AND COMPANY (US) 2001-09-13 WO disclosed