SCHEMBL7015597

SCHEMBL7015597

CCc1cc2c(OCC(=O)OC)cccn2c1C(=O)c1ccccc1-c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 13/20 0.54
PLA2G2A P14555 5/20 0.44
PLA2G2E Q9NZK7 3/20 0.44
PLA2G5 P39877 2/20 0.44
PLA2G10 O15496 1/20 0.42
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
PLA2G2F Q9BZM2 1/20 0.40

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
SCHEMBL7013840 0.87 PLA2G1B (0.47) PLA2G1BPLA2G2APLA2G2EPLA2G5
SCHEMBL7013828 0.83 PLA2G1B (0.67) PLA2G1BPLA2G2APLA2G2EPLA2G5PLA2G10
SCHEMBL7007813 0.77 PLA2G1B (0.66) PLA2G1BKDM4EMEN1ALDH1A1MAPT
SCHEMBL7011531 0.75 PLA2G1B (0.64) PLA2G1BPLA2G2APLA2G2EPLA2G5PLA2G10
SCHEMBL7010713 0.75 PLA2G1B (0.64) PLA2G1BPLA2G2APLA2G2EPLA2G5PLA2G10
SCHEMBL8024688 0.74 PLA2G1B (0.57) PLA2G1BPLA2G2APLA2G2EPLA2G5PLA2G10
SCHEMBL7010592 0.74 PLA2G1B (0.61) PLA2G1BPLA2G2APLA2G2EPLA2G5PLA2G10
SCHEMBL7006648 0.73 PLA2G1B (0.44) PLA2G1BMEN1ALDH1A1MAPTKMT2A
SCHEMBL8022769 0.73 PLA2G1B (0.66) PLA2G1BPLA2G2APLA2G2EPLA2G5PLA2G10
SCHEMBL7013371 0.73 PLA2G1B (0.63) PLA2G1BKDM4EMEN1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6645976-B1 Nonpancreatic secretory phospholipase (sPLA2) supressors such as 2-(3-Benzyl-8-hydroxy-2-ethylindolizin-1-yl)acetamide, administered to control release of fatty acid and prevent the arachidonic acid cascade; septic shock ELI LILLY AND COMPANY 2003-11-11 US disclosed
EP-0772596-B1 INDOLIZINE sPLA2 INHIBITORS LILLY CO ELI (US) 2003-10-01 EP disclosed
EP-0772596-A4 INDOLIZINE sPLA2 INHIBITORS LILLY CO ELI (US) 1999-01-13 EP disclosed
EP-0772596-A1 INDOLIZINE sPLA2 INHIBITORS ELI LILLY AND COMPANY (US) 1997-05-14 EP disclosed
WO-1996003383-A1 INDOLIZINE sPLA2 INHIBITORS ELI LILLY AND COMPANY (US) 1996-02-08 WO disclosed