SCHEMBL20570689

SCHEMBL20570689

CN(Cc1ccc(C(F)(F)F)c(N2CCC(F)CC2)c1)C1(C)CCN(C(=O)O)CC1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.41
MGLL Q99685 4/20 0.40
NOTUM Q6P988 2/20 0.34
CYP2C9 P11712 1/20 0.34
WDR5 P61964 6/20 0.34
FAAH O00519 1/20 0.33
TTR P02766 1/20 0.33

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
SCHEMBL20571082 0.91 MGLL (0.40) FFAR4MGLLNOTUMCYP2C9FAAH
SCHEMBL20571126 0.89 GPR119 (0.41) FFAR4MGLL
SCHEMBL20570209 0.84 SLC6A2 (0.35) FFAR4MGLL
SCHEMBL30458111 0.84 SLC6A2 (0.35) FFAR4MGLL
SCHEMBL20570789 0.80 MGLL (0.45) MGLLFAAH
SCHEMBL20567269 0.76 MGLL (0.59) MGLLFAAH
SCHEMBL20920515 0.74 MGLL (0.49) MGLLFAAH
SCHEMBL20571807 0.74 MGLL (0.36) FFAR4MGLLNOTUM
SCHEMBL20569877 0.74 TACR1 (0.42) MGLL
SCHEMBL30458402 0.74 TACR1 (0.42) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3634404-A1 PYRAZOLE MAGL INHIBITORS Lundbeck La Jolla Research Center, Inc. (US) 2020-04-15 EP disclosed
WO-2018217809-A1 PYRAZOLE MAGL INHIBITORS ABIDE THERAPEUTICS, INC. (US) 2018-11-29 WO disclosed