SCHEMBL15949459

SCHEMBL15949459

O=C(c1ccccc1)N1CCN(C2CN(C(=O)c3ccc(-c4ccccc4Cl)cc3)C2)CC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.51
POLB P06746 1/20 0.51
ALDH1A1 P00352 1/20 0.51
MGLL Q99685 7/20 0.51
L3MBTL3 Q96JM7 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
GHSR Q92847 1/20 0.48
SMO Q99835 1/20 0.48
ACACB O00763 1/20 0.47
ACACA Q13085 1/20 0.47
FASN P49327 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CYP2C9 P11712 1/20 0.46

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
SCHEMBL15949277 0.86 MGLL (0.60) KDM4EPOLBALDH1A1MGLLL3MBTL3
SCHEMBL15949476 0.86 HPGD (0.62) KDM4EPOLBALDH1A1MGLLL3MBTL3
SCHEMBL15949373 0.85 MGLL (0.53) KDM4EPOLBALDH1A1MGLLL3MBTL3
SCHEMBL15949303 0.84 SMO (0.53) KDM4EPOLBALDH1A1MGLLL3MBTL3
SCHEMBL3769283 0.84 SLC6A7 (0.58) ALDH1A1MGLLMEN1KMT2A
SCHEMBL15949306 0.83 MGLL (0.53) KDM4EPOLBALDH1A1MGLLL3MBTL3
SCHEMBL3770758 0.82 MGLL (0.51) KDM4EPOLBALDH1A1MGLLL3MBTL3
SCHEMBL911362 0.82 SLC6A7 (0.61) KDM4EPOLBALDH1A1MGLLL3MBTL3
SCHEMBL911236 0.81 ALDH1A1 (0.60) KDM4EPOLBALDH1A1MGLLMEN1
SCHEMBL15949361 0.81 L3MBTL3 (0.56) KDM4EPOLBALDH1A1MGLLL3MBTL3

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