SCHEMBL9080609

SCHEMBL9080609

Cc1c(NC(=O)C=O)c2c(O)cccn2c1Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 11/20 0.47
ALDH1A1 P00352 4/20 0.36
HTT P42858 1/20 0.36
ALOX5 P09917 1/20 0.32
PLA2G10 O15496 1/20 0.32
PLA2G2A P14555 1/20 0.32
PLA2G5 P39877 1/20 0.32
PLA2G2E Q9NZK7 1/20 0.32
LMNA P02545 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
KDM4E B2RXH2 1/20 0.32
LTA4H P09960 1/20 0.32
FABP4 P15090 1/20 0.32

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
SCHEMBL9081139 0.89 PLA2G1B (0.45) PLA2G1BALDH1A1HTTPLA2G2APLA2G5
SCHEMBL8352190 0.84 PLA2G1B (0.61) PLA2G1BPLA2G10PLA2G2APLA2G5PLA2G2E
SCHEMBL8327335 0.82 PLA2G1B (0.42) PLA2G1BALDH1A1HTTLMNANPSR1
SCHEMBL9081699 0.77 PLA2G1B (0.49) PLA2G1BALDH1A1PLA2G2ALMNAKDM4E
SCHEMBL9080332 0.75 PLA2G2A (0.52) PLA2G1BPLA2G10PLA2G2APLA2G5PLA2G2E
SCHEMBL8025842 0.73 PLA2G1B (0.64) PLA2G1BPLA2G2APLA2G5PLA2G2E
SCHEMBL7006970 0.73 PLA2G1B (0.71) PLA2G1BPLA2G10PLA2G2APLA2G5PLA2G2E
SCHEMBL8026001 0.72 PLA2G1B (0.54) PLA2G1BPLA2G2APLA2G5PLA2G2E
SCHEMBL9081766 0.70 PLA2G1B (0.52) PLA2G1BPLA2G10PLA2G2APLA2G5PLA2G2E
SCHEMBL9081375 0.68 PLA2G1B (0.71) PLA2G1BPLA2G2A

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