SCHEMBL4088554

SCHEMBL4088554

CC1(c2ccc(Cl)c(C(F)(F)F)c2)CNC(=O)N1C1C2CC3CC1CC(O)(C3)C2

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 4/20 0.39
OPRL1 P41146 5/20 0.37
OPRM1 P35372 4/20 0.37
OPRD1 P41143 3/20 0.37
OPRK1 P41145 1/20 0.37
GRIN2B Q13224 3/20 0.36
HSD11B1 P28845 3/20 0.36
AR P10275 1/20 0.35
P2RX7 Q99572 1/20 0.33
EPHX2 P34913 1/20 0.33
SIGMAR1 Q99720 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
SCHEMBL4078974 0.85 HSD11B1 (0.37) HSD11B1
SCHEMBL4083825 0.83 HSD11B1 (0.38) HSD11B1
SCHEMBL4078926 0.83 HSD11B1 (0.38) HSD11B1
SCHEMBL4081766 0.83 HSD11B1 (0.38) HSD11B1
SCHEMBL4078964 0.83 HSD11B1 (0.47) CCR2OPRL1OPRM1OPRD1OPRK1
SCHEMBL4088080 0.82 CHRNA1 (0.37) CCR2HSD11B1
SCHEMBL4082590 0.81 HSD11B1 (0.46) HSD11B1
SCHEMBL4088681 0.81 HSD11B1 (0.43) HSD11B1
SCHEMBL4082249 0.80 CTSD (0.40) HSD11B1
SCHEMBL4086632 0.79 HSD11B1 (0.45) CCR2HSD11B1

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