SCHEMBL15949404

SCHEMBL15949404

O=C(c1ccc(Cc2cccc(C(F)(F)F)c2)cc1)N1CC(N2CCN(C(=O)c3cscn3)CC2)C1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 7/20 0.57
GPR52 Q9Y2T5 2/20 0.43
POLB P06746 1/20 0.42
SLC6A7 Q99884 1/20 0.41
ABL1 P00519 1/20 0.41
BCR P11274 1/20 0.41
MAPK8 P45983 1/20 0.40
MAPK10 P53779 1/20 0.40
PARP1 P09874 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
SCHEMBL912450 0.91 MGLL (0.60) MGLLPOLBSLC6A7MAPK10
SCHEMBL15949209 0.91 MGLL (0.60) MGLLPOLBSLC6A7MAPK10
SCHEMBL14648051 0.89 MGLL (0.54) MGLLPOLBSLC6A7ABL1BCR
SCHEMBL14877410 0.88 GPR52 (0.49) MGLLGPR52SLC6A7
SCHEMBL912390 0.88 MGLL (0.54) MGLLPOLBABL1BCR
SCHEMBL911839 0.87 MGLL (0.60) MGLLPOLBSLC6A7ABL1BCR
SCHEMBL911158 0.87 MGLL (0.60) MGLLPOLBSLC6A7ABL1BCR
SCHEMBL693719 0.86 MGLL (0.54) MGLLABL1BCR
SCHEMBL15196702 0.86 MGLL (0.57) MGLLGPR52POLBMAPK8MAPK10
SCHEMBL694296 0.85 MGLL (0.60) MGLLPOLBSLC6A7ABL1BCR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2421823-B1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2015-01-14 EP disclosed
EP-2421825-B9 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2014-08-20 EP disclosed
EP-2421825-B1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2014-01-01 EP disclosed