SCHEMBL13148482

SCHEMBL13148482

C=C(c1ccc(F)cc1)N1CCN(C2CN(C(=O)c3ccc(-c4ccccc4)cc3)C2)CC1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
SLC6A7 Q99884 3/20 0.56
MGLL Q99685 1/20 0.54
HSD11B1 P28845 2/20 0.54
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 2/20 0.53
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
ATM Q13315 1/20 0.47
POLB P06746 2/20 0.47
HPGD P15428 1/20 0.47
MAPK1 P28482 1/20 0.47
PAX8 Q06710 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
FASN P49327 1/20 0.45
L3MBTL3 Q96JM7 1/20 0.45

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
SCHEMBL911620 0.92 MEN1 (0.66) MEN1KMT2ASLC6A7MGLLHSD11B1
SCHEMBL15949456 0.89 MGLL (0.65) MEN1KMT2ASLC6A7MGLLHSD11B1
SCHEMBL15949270 0.85 MGLL (0.69) MEN1KMT2ASLC6A7MGLLHSD11B1
SCHEMBL15949476 0.84 HPGD (0.62) MEN1KMT2ASLC6A7MGLLKDM4E
SCHEMBL7873064 0.83 MGLL (0.50) MEN1KMT2AMGLLKDM4EALDH1A1
SCHEMBL911264 0.81 HTT (0.63) MEN1KMT2ASLC6A7MGLLKDM4E
SCHEMBL911565 0.81 HTT (0.63) MEN1KMT2ASLC6A7MGLLKDM4E
SCHEMBL16354227 0.81 MGLL (0.57) MEN1KMT2ASLC6A7MGLLHSD11B1
SCHEMBL912019 0.80 MEN1 (0.58) MEN1KMT2ASLC6A7MGLLKDM4E
SCHEMBL2720346 0.79 HSD11B1 (0.74) MEN1KMT2ASLC6A7MGLLHSD11B1

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
WO-2010124112-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO disclosed
WO-2010124102-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO disclosed
WO-2010124108-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO disclosed