SCHEMBL7964652

SCHEMBL7964652

CCc1c(C(=O)C(N)=O)c2c(OC)cccc2n1Cc1cccc(Cl)c1

nearest known ligand 0.83

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 20/20 0.83
PLA2G1B P04054 4/20 0.79
PLA2G10 O15496 4/20 0.66
PLA2G2E Q9NZK7 4/20 0.66
PLA2G2D Q9UNK4 4/20 0.66
PLA2G5 P39877 3/20 0.66
PLA2G2F Q9BZM2 3/20 0.66
PLA2G6 O60733 1/20 0.66
PLA2G2C Q5R387 1/20 0.66
PLA2G12B Q9BX93 1/20 0.66
PLA2G12A Q9BZM1 1/20 0.66
PLA2G3 Q9NZ20 1/20 0.66

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
SCHEMBL7962736 0.91 PLA2G2A (1.00) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G2D
SCHEMBL2157074 0.90 PLA2G2A (0.77) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G2D
SCHEMBL818717 0.89 PLA2G2A (0.83) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G2D
SCHEMBL818585 0.89 PLA2G2A (1.00) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G2D
SCHEMBL2164905 0.89 PLA2G2A (0.74) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G2D
Acetic Acid Methyl Ester SCHEMBL27783503 0.85 PLA2G2A (0.67) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G2D
SCHEMBL8502447 0.85 PLA2G2A (0.67) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G2D
SCHEMBL8505094 0.84 PLA2G2A (0.70) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G2D
SCHEMBL7965344 0.84 PLA2G2A (0.83) PLA2G2APLA2G1B
SCHEMBL8502450 0.83 PLA2G2A (0.64) PLA2G2APLA2G1BPLA2G10PLA2G2EPLA2G2D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6252084-B1 THERAPY FOR SEPSIS SHOCK ELI LILLY AND COMPANY 2001-06-26 US disclosed
EP-0620215-B1 1H-indole-3-acetamide derivatives as sPLA2 inhibitors LILLY CO ELI (US) 1999-08-18 EP disclosed
US-5684034-A INHIBITORS OF HUMAN NON-PANCREATIC SECRETORY PHOSPHOLIPASE A2, TREATMENT OF SEPTIC SHOCK, TRAUMA, RESPIRATORY DISORDERS, RHEUMATIC ARTHRITIS, INHIBITORS OF ARACHIDONIC ACID RELEASE ELI LILLY AND COMPANY (US) 1997-11-04 US disclosed
EP-0620215-A1 1H-indole-3-acetamide derivatives as sPLA2 inhibitors ELI LILLY AND COMPANY (US) 1994-10-19 EP disclosed