SCHEMBL4082514

SCHEMBL4082514

CC1(C)CN(C2C3CC4CC(O)(C3)CC2(Cc2cccc(Cl)c2)C4)C(=O)N1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.37
CHRM2 P08172 3/20 0.34
CHRM3 P20309 3/20 0.34
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
CYP2D6 P10635 1/20 0.33
PABPC1 P11940 1/20 0.31
GRIN2B Q13224 1/20 0.31
TP53 P04637 1/20 0.31
MDM2 Q00987 1/20 0.31
NPC1 O15118 1/20 0.31
AMPD2 Q01433 1/20 0.31
KMT2A Q03164 1/20 0.30
SSTR1 P30872 1/20 0.30
SSTR4 P31391 1/20 0.30
MAPT P10636 1/20 0.30
MMP2 P08253 1/20 0.30
ADAMTS5 Q9UNA0 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
SCHEMBL4088855 0.79 HSD11B1 (0.34) HSD11B1
SCHEMBL4078948 0.79 HSD11B1 (0.38) HSD11B1CHRM2CHRM3
SCHEMBL4089219 0.76 HSD11B1 (0.30) HSD11B1
SCHEMBL4078786 0.70 HSD11B1 (0.34) HSD11B1
SCHEMBL4083375 0.69 HSD11B1 (0.32) HSD11B1
SCHEMBL75289 0.68 HSD11B1 (0.50) HSD11B1
SCHEMBL5507966 0.67 KMT2A (0.36) HSD11B1KMT2A
SCHEMBL75312 0.66 HSD11B1 (0.48) HSD11B1AMPD2KMT2A
SCHEMBL76134 0.65 HSD11B1 (0.45) HSD11B1
SCHEMBL4082512 0.64 HSD11B1 (0.40) HSD11B1CYP2C9CYP2C19TP53AMPD2

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