SCHEMBL7016187

SCHEMBL7016187

COC(=O)CNc1cccn2c(Cc3ccccc3)c(C)c(C(=O)C(N)=O)c12

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 18/20 0.69
PLA2G2A P14555 3/20 0.50
PLA2G10 O15496 1/20 0.50
PLA2G5 P39877 1/20 0.50
PLA2G2E Q9NZK7 1/20 0.50

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
SCHEMBL7007751 0.91 PLA2G1B (0.84) PLA2G1BPLA2G2APLA2G10PLA2G5PLA2G2E
SCHEMBL7010224 0.84 PLA2G1B (0.60) PLA2G1BPLA2G2A
SCHEMBL7011505 0.81 PLA2G1B (0.65) PLA2G1BPLA2G2APLA2G10PLA2G5PLA2G2E
SCHEMBL7006970 0.80 PLA2G1B (0.71) PLA2G1BPLA2G2APLA2G10PLA2G5PLA2G2E
SCHEMBL7018369 0.78 PLA2G1B (1.00) PLA2G1BPLA2G2APLA2G10PLA2G5PLA2G2E
SCHEMBL7102348 0.78 PLA2G1B (0.84) PLA2G1BPLA2G2APLA2G10PLA2G5PLA2G2E
SCHEMBL7013779 0.76 PLA2G1B (0.83) PLA2G1BPLA2G2APLA2G10PLA2G5PLA2G2E
SCHEMBL7013044 0.74 PLA2G1B (0.61) PLA2G1BPLA2G2APLA2G10PLA2G5PLA2G2E
SCHEMBL7012864 0.74 PLA2G1B (0.73) PLA2G1BPLA2G2APLA2G10PLA2G5PLA2G2E
SCHEMBL7010786 0.72 PLA2G1B (0.70) PLA2G1BPLA2G2APLA2G10PLA2G5PLA2G2E

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
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