SCHEMBL15949477

SCHEMBL15949477

O=C(c1ccccc1)N1CCN(C2CN(C(=O)c3ccc(OCc4ccccc4)cc3)C2)CC1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A7 Q99884 2/20 0.63
ALDH1A1 P00352 5/20 0.54
HPGD P15428 3/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
PKM P14618 1/20 0.53
MAPK1 P28482 1/20 0.53
NAAA Q02083 1/20 0.53
MGLL Q99685 3/20 0.53
NPC1 O15118 3/20 0.52
MAPT P10636 2/20 0.52
RAB9A P51151 2/20 0.52
NR4A1 P22736 1/20 0.51
NR4A2 P43354 1/20 0.51
NR4A3 Q92570 1/20 0.51
KDM4E B2RXH2 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
LMNA P02545 2/20 0.50
CASP3 P42574 1/20 0.50
SENP8 Q96LD8 1/20 0.50

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
SCHEMBL911234 0.92 ALDH1A1 (0.65) SLC6A7ALDH1A1HPGDMEN1KMT2A
SCHEMBL912523 0.92 SLC6A7 (0.60) SLC6A7ALDH1A1HPGDMEN1KMT2A
SCHEMBL912218 0.92 MGLL (0.56) SLC6A7ALDH1A1HPGDMEN1KMT2A
SCHEMBL912376 0.90 MGLL (0.58) SLC6A7ALDH1A1HPGDMEN1KMT2A
SCHEMBL912093 0.90 MGLL (0.58) SLC6A7ALDH1A1MEN1KMT2APKM
SCHEMBL14647865 0.90 SLC6A7 (0.52) SLC6A7ALDH1A1HPGDMEN1KMT2A
SCHEMBL14648195 0.90 MGLL (0.58) SLC6A7ALDH1A1HPGDMEN1KMT2A
SCHEMBL912086 0.89 SLC6A7 (0.51) SLC6A7ALDH1A1HPGDMEN1KMT2A
SCHEMBL693102 0.87 S1PR1 (0.53) SLC6A7ALDH1A1HPGDMEN1KMT2A
SCHEMBL912442 0.87 SLC6A7 (0.49) SLC6A7ALDH1A1HPGDMEN1KMT2A

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