SCHEMBL14214972

SCHEMBL14214972

Bc1cc([C@@H](c2ccccc2)C(C)(C)C(=O)Nc2nccs2)ccc1OC

nearest known ligand 0.73

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 20/20 0.73
PGR P06401 4/20 0.68
AR P10275 3/20 0.68

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
SCHEMBL2899087 0.89 NR3C1 (0.77) NR3C1PGRAR
SCHEMBL12592875 0.89 NR3C1 (0.77) NR3C1PGRAR
SCHEMBL2901550 0.89 NR3C1 (0.77) NR3C1PGRAR
SCHEMBL12592898 0.87 NR3C1 (0.71) NR3C1PGRAR
SCHEMBL2901234 0.86 NR3C1 (0.78) NR3C1PGRAR
SCHEMBL12592842 0.85 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL12592843 0.85 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL2893737 0.85 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL2896226 0.84 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL2903919 0.84 NR3C1 (0.82) 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