SCHEMBL4253053

SCHEMBL4253053

CC(=O)NC12CC3CC(C1)C(N1CC4(Cc5ccccc5C4)NC1=O)C(C3)C2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.40
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
FAAH O00519 2/20 0.36
PSMB5 P28074 1/20 0.35
EPHX2 P34913 3/20 0.34
HTT P42858 2/20 0.34
HPGD P15428 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
TSHR P16473 1/20 0.34
ALOX12 P18054 1/20 0.34
ATM Q13315 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HSD17B10 Q99714 1/20 0.34
LMNA P02545 1/20 0.34
BCHE P06276 1/20 0.33
MAPK1 P28482 1/20 0.33
DPP8 Q6V1X1 1/20 0.33

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
SCHEMBL75817 1.00 CNR2 (0.40) CNR2MEN1KMT2AFAAHPSMB5
SCHEMBL73719 0.90 CNR2 (0.40) CNR2MEN1KMT2AFAAHPSMB5
SCHEMBL4259160 0.90 CNR2 (0.40) CNR2MEN1KMT2AFAAHPSMB5
SCHEMBL76313 0.88 CNR2 (0.41) CNR2MEN1KMT2AFAAHPSMB5
SCHEMBL75319 0.88 CNR2 (0.41) CNR2MEN1KMT2AFAAHPSMB5
SCHEMBL4255753 0.84 CNR2 (0.34) CNR2ALDH1A1NPSR1LMNAHSD11B1
SCHEMBL4253450 0.83 HSD11B1 (0.34) CNR2ALDH1A1NPSR1LMNAHSD11B1
SCHEMBL75717 0.83 HSD11B1 (0.34) CNR2ALDH1A1NPSR1LMNAHSD11B1
SCHEMBL1574084 0.81 HSD11B1 (0.35) CNR2KMT2AFAAHHSD11B1
SCHEMBL4251570 0.81 HSD11B1 (0.35) CNR2KMT2AFAAHHSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2104665-A2 IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS FOR DIABETES F. Hoffmann-Roche AG (CH) 2009-09-30 EP claimed
WO-2008046758-A2 IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS FOR DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2008-04-24 WO claimed
EP-2104665-A2 IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS FOR DIABETES F. Hoffmann-Roche AG (CH) 2009-09-30 EP disclosed
WO-2008046758-A2 IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS FOR DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2008-04-24 WO disclosed