SCHEMBL14214846

SCHEMBL14214846

CBc1cc([C@H](c2ccccc2)C(C)(C)C(=O)Nc2nccs2)ccc1O

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 20/20 0.75
PGR P06401 5/20 0.75
AR P10275 3/20 0.75

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
SCHEMBL2893006 0.86 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL2892035 0.86 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL2895788 0.86 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL2896226 0.85 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL2893300 0.84 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL2901308 0.84 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL2895752 0.84 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL12592971 0.83 NR3C1 (0.74) NR3C1PGRAR
SCHEMBL12592969 0.83 NR3C1 (0.74) NR3C1PGRAR
SCHEMBL2898614 0.83 NR3C1 (1.00) NR3C1PGRAR

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-2008057862-A2 MODULATORS OF GLUCOCORTICOID RECEPTOR, AP-1, AND/OR NF-ϰB ACTIVITY AND USE THEREOF BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-15 WO disclosed