SCHEMBL21381979

SCHEMBL21381979

CC(C)(C)OC(=O)N1CC(CCOc2ccc(C(F)(F)F)cc2F)C1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.49
SCN9A Q15858 2/20 0.48
CHRNA7 P36544 1/20 0.43
RORC P51449 1/20 0.41
TACR1 P25103 2/20 0.41
PLK1 P53350 1/20 0.40
MAPT P10636 1/20 0.40
NAMPT P43490 1/20 0.40
LIPE Q05469 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
TGFBR1 P36897 1/20 0.39
PDE4B Q07343 1/20 0.39

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
SCHEMBL19833730 0.89 CHRNA7 (0.53) GPR119SCN9ACHRNA7RORCTACR1
SCHEMBL21381923 0.88 MRGPRX4 (0.46) GPR119SCN9ARORC
SCHEMBL21381584 0.85 CHRNA7 (0.46) SCN9ACHRNA7
SCHEMBL21723050 0.83 MGLL (0.51) GPR119RORCTACR1PLK1MAPT
SCHEMBL21381651 0.81 CHRNA7 (0.41) GPR119SCN9ACHRNA7
SCHEMBL2154224 0.80 USP30 (0.44) GPR119SCN9ANAMPTLIPEPDE4B
SCHEMBL23850247 0.78 GPR119 (0.49) GPR119SCN9ACHRNA7RORCTACR1
SCHEMBL23091766 0.77 GPR119 (0.48) GPR119RORCTACR1MAPTLIPE
SCHEMBL23211881 0.77 RORC (0.42) GPR119RORCTACR1MAPTPDE4B
SCHEMBL21723071 0.77 RBP4 (0.49) GPR119

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-3768684-A1 OXAZINE MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS F. Hoffmann-La Roche AG (CH) 2021-01-27 EP disclosed
WO-2019180185-A1 OXAZINE MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2019-09-26 WO disclosed