SCHEMBL4082249

SCHEMBL4082249

CC1(c2ccc(OC(F)(F)F)cc2)CNC(=O)N1C1C2CC3CC1CC(O)(C3)C2

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.40
BACE1 P56817 1/20 0.40
BACE2 Q9Y5Z0 1/20 0.40
HSD11B1 P28845 13/20 0.37
SLC6A4 P31645 3/20 0.35
LIPE Q05469 1/20 0.35
SLC6A3 Q01959 2/20 0.34
TYRO3 Q06418 1/20 0.34

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
SCHEMBL4083815 0.88 HSD11B1 (0.45) CTSDBACE1BACE2HSD11B1
SCHEMBL4088681 0.85 HSD11B1 (0.43) HSD11B1SLC6A3
SCHEMBL4083825 0.83 HSD11B1 (0.38) HSD11B1SLC6A4SLC6A3
SCHEMBL4078926 0.83 HSD11B1 (0.38) HSD11B1SLC6A4SLC6A3
SCHEMBL4081766 0.83 HSD11B1 (0.38) HSD11B1SLC6A4SLC6A3
SCHEMBL4082564 0.83 HSD11B1 (0.44) HSD11B1
SCHEMBL4088080 0.81 CHRNA1 (0.37) HSD11B1SLC6A3
SCHEMBL4088554 0.80 CCR2 (0.39) HSD11B1
SCHEMBL4079142 0.80 HSD11B1 (0.38) HSD11B1SLC6A4SLC6A3
SCHEMBL4078964 0.79 HSD11B1 (0.47) HSD11B1

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-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