SCHEMBL7968065

SCHEMBL7968065

Cc1c(C(O)C(N)=O)c2cc([N+](=O)[O-])ccc2n1Cc1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 10/20 0.69
PLA2G10 O15496 1/20 0.60
LMNA P02545 1/20 0.47
AR P10275 3/20 0.46
RAD52 P43351 1/20 0.46

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
SCHEMBL27532541 0.90 PLA2G2A (0.56) PLA2G2APLA2G10LMNAARRAD52
SCHEMBL7964627 0.81 PLA2G2A (1.00) PLA2G2A
SCHEMBL7952555 0.81 PLA2G2A (0.70) PLA2G2APLA2G10LMNAAR
SCHEMBL3385771 0.80 PLA2G2A (0.69) PLA2G2ALMNAAR
SCHEMBL3389070 0.76 LMNA (0.74) PLA2G2ALMNAAR
SCHEMBL7963220 0.75 PLA2G10 (1.00) PLA2G2APLA2G10
SCHEMBL1149940 0.73 KMT2A (0.70) PLA2G2ALMNA
SCHEMBL11467535 0.72 PLA2G2A (0.56) PLA2G2ALMNA
SCHEMBL11109847 0.72 PLA2G2A (0.48) PLA2G2ALMNAAR
SCHEMBL27363619 0.71 PLA2G2A (0.81) PLA2G2ALMNAAR

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