SCHEMBL6661790

SCHEMBL6661790

COC(=O)COc1cccc2c1c1c(n2Cc2cc(F)ccc2F)CCCCC1C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSPO P30536 2/20 0.42
PLA2G2A P14555 8/20 0.41
PTGDR Q13258 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35

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
SCHEMBL5864580 0.91 PLA2G2A (0.44) TSPOPLA2G2APTGDR2
SCHEMBL6657078 0.89 PLA2G2A (0.45) TSPOPLA2G2A
SCHEMBL6657470 0.88 PLA2G2A (0.45) TSPOPLA2G2A
SCHEMBL6659796 0.85 PLA2G2A (0.42) TSPOPLA2G2A
SCHEMBL6657217 0.85 PLA2G2A (0.42) TSPOPLA2G2A
SCHEMBL6657450 0.85 PLA2G2A (0.43) TSPOPLA2G2A
SCHEMBL5508486 0.85 PLA2G2A (0.45) PLA2G2A
SCHEMBL5864516 0.85 PLA2G2A (0.57) TSPOPLA2G2A
SCHEMBL5864601 0.84 PLA2G2A (0.44) TSPOPLA2G2APTGDR2
SCHEMBL6663382 0.84 PLA2G2A (0.47) TSPOPLA2G2A

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
EP-1438290-A1 CYCLOHEPT B!INDOLE DERIVATIVES AS SPLA2 INHIBITORS ELI LILLY AND COMPANY (US) 2004-07-21 EP claimed
WO-2003016277-A1 CYCLOHEPT`B!INDOLE DERIVATIVES AS SPLA2 INHIBITORS ELI LILLY AND COMPANY (US) 2003-02-27 WO claimed