SCHEMBL14830659

SCHEMBL14830659

CC(C)(C)OC(=O)NCCc1cccc(N2CCN(C(=O)O)CC2)c1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.50
MEN1 O00255 1/20 0.50
POLB P06746 1/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
KMT2A Q03164 1/20 0.50
NAMPT P43490 1/20 0.47
AKT1 P31749 1/20 0.44
DRD2 P14416 3/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
NQO2 P16083 1/20 0.43
FAAH O00519 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
IDO1 P14902 1/20 0.42
CTSL P07711 1/20 0.42
CTSS P25774 1/20 0.42
CTSK P43235 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
SCHEMBL21591743 0.88 SIGMAR1 (0.48) SIGMAR1MEN1POLBGAAMAPT
SCHEMBL21457821 0.86 NAMPT (0.53) SIGMAR1MEN1GAAMAPTKMT2A
SCHEMBL5677044 0.79 MCHR1 (0.48) SIGMAR1NAMPTAKT1NQO2
SCHEMBL20303810 0.77 SIGMAR1 (0.56) SIGMAR1MAPTNAMPTDRD2
SCHEMBL19211125 0.77 SIGMAR1 (0.52) SIGMAR1MEN1GAAMAPTKMT2A
SCHEMBL14367982 0.77 PRMT6 (0.56) MEN1POLBGAAMAPTKMT2A
SCHEMBL24641798 0.77 GPR119 (0.50) MEN1POLBGAAMAPTKMT2A
SCHEMBL30017169 0.77 GPR119 (0.50) MEN1POLBGAAMAPTKMT2A
SCHEMBL1718277 0.76 NQO2 (0.51) SIGMAR1POLBNAMPTAKT1NQO2
SCHEMBL5683294 0.76 GPR119 (0.55) MEN1MAPTKMT2ANAMPT

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-2760840-A1 QUINOLINONE CARBOXAMIDE INHIBITORS OF ENDOTHELIAL LIPASE Bristol-Myers Squibb Company (US) 2014-08-06 EP disclosed
WO-2013048942-A1 QUINOLINONE CARBOXAMIDE INHIBITORS OF ENDOTHELIAL LIPASE BRISTOL-MYERS SQUIBB COMPANY (US) 2013-04-04 WO disclosed