SCHEMBL7411643

SCHEMBL7411643

N#Cc1cccc(CCn2c3cccc(OCC(=O)O)c3c3c(C(N)=O)cccc32)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 15/20 0.46
PLA2G1B P04054 7/20 0.44
PLA2G10 O15496 3/20 0.44
PLA2G2E Q9NZK7 3/20 0.44
PLA2G5 P39877 2/20 0.44
PLA2G2F Q9BZM2 2/20 0.43
PLA2G2D Q9UNK4 2/20 0.43
PLA2G6 O60733 1/20 0.43
PLA2G2C Q5R387 1/20 0.43
PLA2G12B Q9BX93 1/20 0.43
PLA2G12A Q9BZM1 1/20 0.43
PLA2G3 Q9NZ20 1/20 0.43
PTGDR2 Q9Y5Y4 2/20 0.41
FFAR1 O14842 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
ADRA1D P25100 1/20 0.39

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
SCHEMBL818699 0.91 PLA2G2A (0.52) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G5
SCHEMBL29862301 0.91 PLA2G2A (0.52) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G5
SCHEMBL6776872 0.87 PLA2G2A (0.55) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G5
SCHEMBL6692598 0.85 PLA2G2A (0.48) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G5
SCHEMBL6535283 0.84 PLA2G2A (0.46) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G5
SCHEMBL7967330 0.83 PLA2G2A (0.52) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G5
SCHEMBL30410934 0.82 PLA2G2A (0.49) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G5
SCHEMBL7944526 0.82 PLA2G2A (0.49) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G5
SCHEMBL7968417 0.82 PLA2G2A (0.49) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G5
SCHEMBL7966857 0.82 PLA2G2A (0.49) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G5

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1259260-A1 COMBINATION THERAPY FOR THE TREATMENT OF INFLAMMATORY AND RESPIRATORY DISEASES ELI LILLY AND COMPANY (US) 2002-11-27 EP disclosed
WO-2001049323-A1 COMBINATION THERAPY FOR THE TREATMENT OF INFLAMMATORY AND RESPIRATORY DISEASES ELI LILLY AND COMPANY (US) 2001-07-12 WO disclosed