SCHEMBL15949412

SCHEMBL15949412

O=C(CCc1ccccc1Cl)N1CC(N2CCN(C(=O)c3ccccc3)CC2)C1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.48
ALDH1A1 P00352 3/20 0.48
POLB P06746 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.45
L3MBTL3 Q96JM7 1/20 0.45
ACACB O00763 3/20 0.45
ACACA Q13085 3/20 0.45
BLM P54132 1/20 0.44
MGLL Q99685 2/20 0.44
HRH3 Q9Y5N1 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
SLC18A3 Q16572 1/20 0.43
USP2 O75604 1/20 0.43
APP P05067 1/20 0.42

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
SCHEMBL15949225 0.89 KDM4E (0.48) KDM4EALDH1A1POLBL3MBTL1L3MBTL3
SCHEMBL15949432 0.86 KDM4E (0.56) KDM4EALDH1A1POLBL3MBTL1L3MBTL3
SCHEMBL15949405 0.84 ACACB (0.51) KDM4EALDH1A1POLBL3MBTL1L3MBTL3
SCHEMBL15949302 0.84 MEN1 (0.54) KDM4EALDH1A1POLBMGLLHRH3
SCHEMBL15949180 0.84 TACR2 (0.48) KDM4EALDH1A1POLBACACBACACA
SCHEMBL912358 0.81 MGLL (0.53) MGLLAPP
SCHEMBL15949434 0.81 KDM4E (0.53) KDM4EALDH1A1POLBL3MBTL1TSHR
SCHEMBL15949250 0.80 KMT2A (0.50) KDM4EALDH1A1POLBL3MBTL1L3MBTL3
SCHEMBL15949415 0.80 ALDH1A1 (0.48) KDM4EALDH1A1POLBL3MBTL1L3MBTL3
SCHEMBL912264 0.79 SMN1; SMN2 (0.48) KDM4EALDH1A1POLBL3MBTL1L3MBTL3

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