SCHEMBL2006541

SCHEMBL2006541

COc1cc(-c2cc(Cl)cnc2OC)ccc1[C@@H](C)NS(=O)(=O)c1cn(C)nc1C(F)(F)F

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 4/20 0.62
PGR P06401 2/20 0.56
PIK3C3 Q8NEB9 2/20 0.40
SGK1 O00141 1/20 0.39
SCN9A Q15858 4/20 0.37
METAP2 P50579 2/20 0.36
FGFR1 P11362 1/20 0.34
FGFR2 P21802 1/20 0.34
FGFR3 P22607 1/20 0.34
APLNR P35414 1/20 0.33
S1PR1 P21453 1/20 0.33
LRRK2 Q5S007 1/20 0.33
SCN5A Q14524 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
CHRM2 P08172 1/20 0.32
CHRM1 P11229 1/20 0.32
RRM1 P23921 1/20 0.32
RRM2B Q7LG56 1/20 0.32

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
SCHEMBL2008086 0.88 NR3C1 (0.78) NR3C1PGRPIK3C3SGK1METAP2
SCHEMBL2008089 0.79 NR3C1 (0.79) NR3C1PGRPIK3C3SGK1SCN9A
SCHEMBL2002007 0.78 NR3C1 (0.82) NR3C1PGRPIK3C3SGK1CHRM2
SCHEMBL27780295 0.78 NR3C1 (0.54) NR3C1PGRPIK3C3SGK1METAP2
SCHEMBL2009788 0.78 NR3C1 (0.58) NR3C1PGRPIK3C3SGK1METAP2
SCHEMBL2007374 0.77 NR3C1 (0.79) NR3C1PGRPIK3C3SGK1APLNR
SCHEMBL27758653 0.74 NR3C1 (0.49) NR3C1PGRPIK3C3SGK1METAP2
SCHEMBL2004015 0.72 NR3C1 (0.44) NR3C1PGRPIK3C3SGK1SCN9A
SCHEMBL2008107 0.72 NR3C1 (1.00) NR3C1PGRSGK1APLNR
SCHEMBL2011360 0.70 NR3C1 (0.45) NR3C1PGRPIK3C3SGK1

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