SCHEMBL4260940

SCHEMBL4260940

CCN1C(=O)N(C2C3CC4CC2CC(C(=O)OC)(C4)C3)CC12CCCC2

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 12/20 0.33
SCN9A Q15858 2/20 0.33
TOP2A P11388 1/20 0.32
ALDH1A1 P00352 3/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HSD11B2 P80365 4/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
TP53 P04637 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31
SCN1A P35498 1/20 0.30
SCN2A Q99250 1/20 0.30
SCN3A Q9NY46 1/20 0.30

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
SCHEMBL4258533 0.76 ALDH1A1 (0.36) HSD11B1SCN9AALDH1A1L3MBTL1HSD11B2
SCHEMBL708623 0.76 HSD11B1 (0.34) HSD11B1SCN9AHSD11B2SCN1ASCN2A
SCHEMBL1118091 0.74 HSD11B1 (0.35) HSD11B1SCN9AHSD11B2
SCHEMBL705638 0.70 HSD11B1 (0.37) HSD11B1SCN9AALDH1A1
SCHEMBL4089109 0.69 HSD11B1 (0.39) HSD11B1SCN9AALDH1A1HSD11B2KDM4E
SCHEMBL15831171 0.69 GLA (0.47) HSD11B1SCN9AALDH1A1L3MBTL1MEN1
SCHEMBL328911 0.69 HSD11B1 (0.49) HSD11B1SCN9AALDH1A1HSD11B2SCN1A
SCHEMBL1116549 0.69 HSD11B1 (0.41) HSD11B1ALDH1A1
SCHEMBL4088428 0.68 HSD11B1 (0.39) HSD11B1SCN9AHSD11B2
SCHEMBL75365 0.67 HSD11B1 (0.45) 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