SCHEMBL2006930

SCHEMBL2006930

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

nearest known ligand 0.78

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 9/20 0.78
PGR P06401 7/20 0.78
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
KMT2A Q03164 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
S1PR1 P21453 1/20 0.41
CASR P41180 1/20 0.40

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 0.88 NR3C1 (1.00) NR3C1PGRCASR
SCHEMBL2004253 0.83 NR3C1 (0.69) NR3C1PGRCASR
SCHEMBL2010050 0.79 NR3C1 (0.67) NR3C1PGRSMN1; SMN2CASR
SCHEMBL2002007 0.78 NR3C1 (0.82) NR3C1PGRCASR
SCHEMBL2002566 0.77 NR3C1 (0.59) NR3C1PGRSMN1; SMN2CASR
SCHEMBL2007374 0.77 NR3C1 (0.79) NR3C1PGRS1PR1CASR
SCHEMBL2005610 0.76 NR3C1 (0.62) NR3C1PGRMEN1ALDH1A1KMT2A
SCHEMBL2005613 0.76 NR3C1 (0.62) NR3C1PGRMEN1ALDH1A1KMT2A
SCHEMBL2008089 0.73 NR3C1 (0.79) NR3C1PGRS1PR1
SCHEMBL2008128 0.71 NR3C1 (0.54) NR3C1PGRMEN1ALDH1A1KMT2A

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