SCHEMBL2007353

SCHEMBL2007353

C[C@@H](NS(=O)(=O)c1cn(C)nc1C(F)(F)F)c1ccc(-c2cccnc2OC(F)F)cc1

nearest known ligand 0.85

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 6/20 0.85
PGR P06401 4/20 0.62
PIK3C3 Q8NEB9 2/20 0.37
SGK1 O00141 1/20 0.37
TRPV4 Q9HBA0 1/20 0.37
SYK P43405 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35
ALOX5AP P20292 2/20 0.34
FEN1 P39748 1/20 0.34
S1PR1 P21453 1/20 0.34
SCN9A Q15858 2/20 0.33
WDR5 P61964 1/20 0.33
BRD4 O60885 1/20 0.33
CREBBP Q92793 1/20 0.33

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
SCHEMBL2008089 0.79 NR3C1 (0.79) NR3C1PGRPIK3C3SGK1ALOX5AP
SCHEMBL2008086 0.78 NR3C1 (0.78) NR3C1PGRPIK3C3SGK1FFAR4
SCHEMBL2008107 0.76 NR3C1 (1.00) NR3C1PGRSGK1BRD4
SCHEMBL2002007 0.76 NR3C1 (0.82) NR3C1PGRPIK3C3SGK1
SCHEMBL2010022 0.70 NR3C1 (0.54) NR3C1PGRALOX5APFEN1
SCHEMBL2010021 0.70 NR3C1 (0.54) NR3C1PGRALOX5APFEN1
SCHEMBL2008608 0.68 NR3C1 (0.54) NR3C1PGRTRPV4FFAR4ALOX5AP
SCHEMBL5239044 0.68 NR3C1 (0.54) NR3C1PGRTRPV4FFAR4ALOX5AP
SCHEMBL2006541 0.67 NR3C1 (0.62) NR3C1PGRPIK3C3SGK1FFAR4
SCHEMBL2005931 0.67 NR3C1 (0.60) NR3C1PGRALOX5APFEN1

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
US-7960365-B2 Compounds with medicinal effects due to interaction with the glucocorticoid receptor N.V. ORGANON (NL) 2011-06-14 US disclosed