SCHEMBL175096

SCHEMBL175096

O=C(O)N1CC(N2Cc3ccccc3C2=O)C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTR Q99707 1/20 0.51
KDM5A P29375 1/20 0.48
MGLL Q99685 1/20 0.46
KMT2A Q03164 2/20 0.46
ALOX15 P16050 4/20 0.46
SCN1A P35498 4/20 0.46
SCN5A Q14524 4/20 0.46
SCN9A Q15858 4/20 0.46
KDM4E B2RXH2 3/20 0.46
TSHR P16473 2/20 0.46
SIRT1 Q96EB6 1/20 0.46
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
CRBN Q96SW2 1/20 0.45
ALDH1A1 P00352 1/20 0.44
XIAP P98170 1/20 0.44
HKDC1 Q2TB90 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL121297 0.80 NAMPT (0.50) MTRKDM5AMGLLSCN1ASCN5A
SCHEMBL121672 0.80 MTR (0.51) MTRKDM5AKMT2ASCN1ASCN5A
SCHEMBL121298 0.79 MGLL (0.58) MTRKDM5AMGLLKMT2ASCN1A
SCHEMBL18216849 0.79 MTR (0.59) MTRKMT2ASCN1ASCN5ASCN9A
SCHEMBL29961279 0.79 MTR (0.59) MTRKMT2ASCN1ASCN5ASCN9A
SCHEMBL12076929 0.78 MTR (0.48) MTRKDM5AKMT2AALOX15SCN1A
SCHEMBL12076927 0.78 MTR (0.48) MTRKDM5AKMT2AALOX15SCN1A
SCHEMBL30358021 0.77 KDM5A (0.50) MTRKDM5ASCN1ASCN5ASCN9A
SCHEMBL147725 0.76 MGLL (0.56) MTRKDM5AMGLLKMT2AALOX15
SCHEMBL149492 0.76 MGLL (0.58) MTRKDM5AMGLLSCN1ASCN5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2611774-A1 DI-AZETIDINYL DIAMIDE AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica, N.V. (BE) 2013-07-10 EP disclosed
WO-2012030907-A1 DI-AZETIDINYL DIAMIDE AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2012-03-08 WO disclosed