SCHEMBL2049288

SCHEMBL2049288

CC(O)CC12CC3CC(C1)C(NC(=O)C(C)(C)N1CCN(c4ccc(C(F)(F)F)cn4)CC1)C(C3)C2

nearest known ligand 0.75

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 20/20 0.75
HSD11B2 P80365 3/20 0.72

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
SCHEMBL233654 0.92 HSD11B1 (0.79) HSD11B1HSD11B2
SCHEMBL232852 0.89 HSD11B1 (0.78) HSD11B1HSD11B2
SCHEMBL232405 0.89 HSD11B1 (0.77) HSD11B1HSD11B2
SCHEMBL230808 0.87 HSD11B1 (0.75) HSD11B1HSD11B2
SCHEMBL233462 0.86 HSD11B1 (1.00) HSD11B1HSD11B2
SCHEMBL230647 0.85 HSD11B1 (0.82) HSD11B1HSD11B2
SCHEMBL235390 0.84 HSD11B1 (0.81) HSD11B1HSD11B2
SCHEMBL231839 0.84 HSD11B1 (1.00) HSD11B1HSD11B2
SCHEMBL233381 0.84 HSD11B1 (0.77) HSD11B1HSD11B2
SCHEMBL6336789 0.83 HSD11B1 (0.79) HSD11B1HSD11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011068927-A2 11-β-HYDROXYSTEROID DEHYDROGENASE TYPE 1 (11B-HSD1) INHIBITORS AND USES THEREOF ABBOTT LABORATORIES (US) 2011-06-09 WO claimed