SCHEMBL3970080

SCHEMBL3970080

Cc1c(N(Cc2ccc(Oc3ccc(Br)c(O)c3)cc2)Cc2ccc(F)cc2F)cccc1[N+](=O)[O-]

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 18/20 0.54
PGR P06401 5/20 0.54
NR3C2 P08235 3/20 0.47
AR P10275 3/20 0.47
TAS2R14 Q9NYV8 1/20 0.36
HSPB1 P04792 1/20 0.35

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
SCHEMBL3970484 0.93 NR3C1 (0.55) NR3C1PGRNR3C2ARTAS2R14
SCHEMBL3963416 0.91 NR3C1 (0.57) NR3C1PGRNR3C2ARTAS2R14
SCHEMBL3960392 0.90 NR3C1 (0.54) NR3C1PGRNR3C2ARTAS2R14
SCHEMBL3968059 0.90 NR3C1 (0.57) NR3C1PGRNR3C2ARTAS2R14
SCHEMBL3967760 0.88 NR3C1 (0.54) NR3C1PGRNR3C2ARTAS2R14
SCHEMBL3966697 0.87 NR3C1 (0.50) NR3C1PGRNR3C2ARTAS2R14
SCHEMBL3968296 0.87 NR3C1 (0.46) NR3C1PGRNR3C2AR
SCHEMBL3963221 0.87 NR3C1 (0.72) NR3C1PGRNR3C2AR
SCHEMBL3963218 0.87 NR3C1 (0.72) NR3C1PGRNR3C2AR
SCHEMBL3967049 0.87 NR3C1 (0.53) NR3C1PGRNR3C2ARTAS2R14

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1363876-B1 GLUCOCORTICOID RECEPTOR MODULATORS KAROBIO AB (SE) 2009-07-29 EP disclosed
EP-1363876-A1 GLUCOCORTICOID RECEPTOR MODULATORS Abbott Laboratories (US) 2003-11-26 EP disclosed
US-6583180-B2 Antidiabetic agents ABBOTT LABORATORIES 2003-06-24 US disclosed
WO-2002064550-A1 GLUCOCORTICOID RECEPTOR MODULATORS ABBOTT LABORATORIES (US) 2002-08-22 WO disclosed