SCHEMBL8924591

SCHEMBL8924591

COC(=O)C(=O)c1cccc2c1c(CC(N)=O)cn2Cc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 9/20 0.61
ICMT O60725 7/20 0.49
P2RX7 Q99572 1/20 0.46
HDAC10 Q969S8 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
ADORA1 P30542 1/20 0.43

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
SCHEMBL8924667 0.88 PLA2G2A (0.64) PLA2G2AICMTADORA1
SCHEMBL7961599 0.82 PLA2G2A (0.76) PLA2G2AICMT
SCHEMBL7963378 0.79 PLA2G2A (0.67) PLA2G2AICMTP2RX7
SCHEMBL8924596 0.79 PLA2G2A (0.59) PLA2G2AICMTP2RX7
SCHEMBL7962192 0.79 PLA2G2A (0.80) PLA2G2AICMT
SCHEMBL8924672 0.78 PLA2G2A (0.72) PLA2G2AICMT
SCHEMBL8926033 0.77 PLA2G2A (0.70) PLA2G2A
SCHEMBL8926207 0.76 PLA2G2A (0.71) PLA2G2A
SCHEMBL7966181 0.76 PLA2G2A (1.00) PLA2G2AICMT
SCHEMBL703149 0.73 PLA2G2A (0.44) PLA2G2AP2RX7HDAC10HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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