SCHEMBL21390455

SCHEMBL21390455

O=C1CO[C@H]2CCN(C(=O)N3CC[C@H](c4cc(Cl)cc(OCC(F)(F)F)c4)C3)C[C@H]2N1

nearest known ligand 0.56

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 12/20 0.56

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
SCHEMBL29849834 1.00 MGLL (0.56) MGLL
SCHEMBL25057213 1.00 MGLL (0.56) MGLL
SCHEMBL21390560 1.00 MGLL (0.56) MGLL
SCHEMBL21390454 1.00 MGLL (0.56) MGLL
SCHEMBL21390453 0.85 MGLL (0.67) MGLL
SCHEMBL23148907 0.85 MGLL (0.67) MGLL
SCHEMBL23148942 0.85 MGLL (0.67) MGLL
SCHEMBL21390407 0.85 MGLL (0.67) MGLL
SCHEMBL23235344 0.83 MGLL (0.52) MGLL
SCHEMBL25057215 0.83 MGLL (0.52) 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-2019180185-A1 OXAZINE MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2019-09-26 WO disclosed