SCHEMBL7616781

SCHEMBL7616781

CCc1c(C(=O)C(N)=O)c2c(C(=O)C(=O)O)nc(C)cn2c1Cc1cccc(F)c1

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 16/20 0.47
PLA2G2A P14555 2/20 0.44
GPR52 Q9Y2T5 1/20 0.37

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
SCHEMBL7645569 0.90 PLA2G1B (0.55) PLA2G1BPLA2G2A
SCHEMBL7645530 0.89 PLA2G1B (0.48) PLA2G1BPLA2G2A
SCHEMBL7187199 0.85 PLA2G1B (0.55) PLA2G1BPLA2G2A
SCHEMBL7641251 0.84 PLA2G1B (0.58) PLA2G1BPLA2G2A
SCHEMBL7643276 0.81 PLA2G1B (0.43) PLA2G1BPLA2G2A
SCHEMBL7641632 0.79 PLA2G1B (0.54) PLA2G1BPLA2G2A
SCHEMBL13888555 0.79 PLA2G1B (0.57) PLA2G1BPLA2G2A
SCHEMBL7946058 0.79 PLA2G2A (0.54) PLA2G1BPLA2G2A
SCHEMBL7643254 0.78 PLA2G1B (0.52) PLA2G1BPLA2G2A
SCHEMBL7643172 0.77 PLA2G2A (0.51) PLA2G1BPLA2G2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1265607-A2 METHOD FOR THE TREATMENT OF RENAL DYSFUNCTION WITH sPLA 2 INHIBITORS ELI LILLY AND COMPANY (US) 2002-12-18 EP disclosed
WO-2001066111-A1 COMPOSITIONS CONTAINING POTENTIAL SPLA2 INHIBITORS FOR THE TREATMENT OF PAIN ELI LILLY AND COMPANY (US) 2001-09-13 WO disclosed
WO-2001066110-A2 METHOD FOR THE TREATMENT OF RENAL DYSFUNCTION WITH sPLA2 INHIBITORS ELI LILLY AND COMPANY (US) 2001-09-13 WO disclosed