SCHEMBL7737352

SCHEMBL7737352

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

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 4/20 0.55
PLA2G1B P04054 17/20 0.50
PLA2G2E Q9NZK7 3/20 0.50
PLA2G5 P39877 2/20 0.50
PLA2G2F Q9BZM2 1/20 0.44
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
SCHEMBL7737362 0.94 PLA2G2A (0.53) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL7737348 0.91 PLA2G2A (0.55) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL7737359 0.90 PLA2G2A (0.54) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL7736657 0.87 PLA2G2A (0.47) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL7187162 0.87 PLA2G1B (0.62) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL7645755 0.84 PLA2G2A (0.54) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL7196785 0.81 PLA2G1B (0.67) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL7193938 0.80 PLA2G1B (0.62) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL7190951 0.80 PLA2G1B (0.59) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F
SCHEMBL7736651 0.78 PLA2G2A (0.47) PLA2G2APLA2G1BPLA2G2EPLA2G5PLA2G2F

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
US-6407104-B1 Pyrrolo[1,2-a]pyrazine spla2 inhibitor SHIONOGI & CO., LTD. (JP) 2002-06-18 US disclosed