SCHEMBL9986986

SCHEMBL9986986

COc1ccc(C(C)N2CCC3(CCC(O)CC3)OC2=O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 20/20 1.00

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
SCHEMBL9986985 1.00 HSD11B1 (1.00) HSD11B1
SCHEMBL11029931 1.00 HSD11B1 (1.00) HSD11B1
SCHEMBL9986984 1.00 HSD11B1 (1.00) HSD11B1
SCHEMBL9986906 0.88 HSD11B1 (1.00) HSD11B1
SCHEMBL11031293 0.88 HSD11B1 (1.00) HSD11B1
SCHEMBL9986904 0.88 HSD11B1 (1.00) HSD11B1
SCHEMBL9986427 0.87 HSD11B1 (1.00) HSD11B1
SCHEMBL11885692 0.87 HSD11B1 (1.00) HSD11B1
SCHEMBL11885693 0.87 HSD11B1 (1.00) HSD11B1
SCHEMBL9986498 0.87 HSD11B1 (1.00) 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-2585444-A1 AZASPIROHEXANONES AS INHIBITORS OF 11-BETA-HSD1 FOR THE TREATMENT OF METABOLIC DISORDERS Boehringer Ingelheim International GmbH (DE) 2013-05-01 EP disclosed
WO-2011161128-A1 AZASPIROHEXANONES AS INHIBITORS OF 11-BETA-HSD1 FOR THE TREATMENT OF METABOLIC DISORDERS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-12-29 WO disclosed