SCHEMBL2002007

SCHEMBL2002007

COc1ccc(Cl)cc1-c1ccc([C@@H](C)NS(=O)(=O)c2cn(C)nc2C(F)(F)F)cc1

nearest known ligand 0.82

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 6/20 0.82
PGR P06401 4/20 0.82
CASR P41180 4/20 0.43
SGK1 O00141 1/20 0.40
CNR2 P34972 2/20 0.39
PIK3C3 Q8NEB9 1/20 0.38
CHRM2 P08172 2/20 0.37
CHRM1 P11229 2/20 0.37
RRM1 P23921 2/20 0.37
RRM2B Q7LG56 2/20 0.37
PTGES2 Q9H7Z7 1/20 0.37

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
SCHEMBL2008107 0.90 NR3C1 (1.00) NR3C1PGRCASRSGK1
SCHEMBL2008086 0.86 NR3C1 (0.78) NR3C1PGRSGK1PIK3C3
SCHEMBL2008089 0.80 NR3C1 (0.79) NR3C1PGRSGK1PIK3C3
SCHEMBL2007374 0.79 NR3C1 (0.79) NR3C1PGRCASRSGK1PIK3C3
SCHEMBL2006541 0.78 NR3C1 (0.62) NR3C1PGRSGK1PIK3C3CHRM2
SCHEMBL2006930 0.78 NR3C1 (0.78) NR3C1PGRCASR
SCHEMBL2007353 0.76 NR3C1 (0.85) NR3C1PGRSGK1PIK3C3
SCHEMBL2004275 0.74 NR3C1 (0.51) NR3C1PGRCNR2
SCHEMBL2009788 0.72 NR3C1 (0.58) NR3C1PGRSGK1CNR2PIK3C3
SCHEMBL2008128 0.69 NR3C1 (0.54) NR3C1PGR

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