SCHEMBL20180000

SCHEMBL20180000

O=C(OC(C(F)(F)F)C(F)(F)F)N1CCN(Cc2ccc(Cl)cc2OCCCCO)CC1

nearest known ligand 0.82

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 20/20 0.82
ABHD6 Q9BV23 6/20 0.65
PLA2G7 Q13093 5/20 0.65

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
SCHEMBL20158328 0.90 MGLL (0.80) MGLLABHD6PLA2G7
SCHEMBL20136984 0.90 MGLL (1.00) MGLLABHD6PLA2G7
SCHEMBL20158270 0.87 MGLL (0.79) MGLLABHD6PLA2G7
SCHEMBL20137042 0.87 MGLL (1.00) MGLLABHD6PLA2G7
SCHEMBL28880215 0.83 MGLL (0.72) MGLLABHD6PLA2G7
SCHEMBL21993876 0.82 MGLL (0.71) MGLLABHD6PLA2G7
SCHEMBL21571708 0.82 MGLL (0.81) MGLLABHD6PLA2G7
SCHEMBL20151757 0.81 MGLL (0.83) MGLLABHD6PLA2G7
SCHEMBL20136962 0.81 MGLL (1.00) MGLLABHD6PLA2G7
SCHEMBL20151812 0.80 MGLL (0.81) MGLL

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
WO-2018093947-A1 MAGL INHIBITORS ABIDE THERAPEUTICS, INC. (US) 2018-05-24 WO disclosed