SCHEMBL365215

SCHEMBL365215

Cc1ccc2c(C(N)=O)c3c(OCCc4ccccc4)cc(OC(=O)N(C)C)cc3n2c1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.36
CYP11B1 P15538 2/20 0.36
CYP11B2 P19099 2/20 0.36
PLA2G10 O15496 2/20 0.35
PLA2G1B P04054 2/20 0.35
PLA2G2A P14555 2/20 0.35
PLA2G5 P39877 2/20 0.35
PLA2G2E Q9NZK7 2/20 0.35
PLK1 P53350 1/20 0.34
SIRT2 Q8IXJ6 2/20 0.34
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
SCN9A Q15858 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
FAAH O00519 1/20 0.32

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
SCHEMBL365005 0.93 CYP11B1 (0.37) ACHECYP11B1CYP11B2PLA2G10PLA2G1B
SCHEMBL366611 0.88 ACHE (0.38) ACHECYP11B1CYP11B2PLA2G10PLA2G1B
SCHEMBL366530 0.85 CYP11B1 (0.35) ACHECYP11B1CYP11B2SCN9A
SCHEMBL366373 0.81 MAPT (0.37) ACHESIGMAR1
SCHEMBL365188 0.81 CYP11B1 (0.39) ACHECYP11B1CYP11B2SCN9A
SCHEMBL365914 0.80 MAPT (0.34) ACHE
SCHEMBL365924 0.80 ACHE (0.42) ACHE
SCHEMBL365216 0.78 ACHE (0.36) ACHECYP11B1CYP11B2PLA2G10PLA2G1B
SCHEMBL366612 0.76 ACHE (0.38) ACHECYP11B1CYP11B2PLK1PDE4A
SCHEMBL366850 0.75 MAPT (0.37) SIGMAR1

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
WO-2012007008-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO claimed
WO-2012007008-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed