SCHEMBL4570011

SCHEMBL4570011

Cc1cc(C)c(C(COc2ccc(F)cc2)C(C)C)c(C)c1.Cc1cc(C)c(S(=O)(=O)NC(CN(C)c2ccccc2)C(C)C)c(C)c1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 17/20 0.48
PGR P06401 5/20 0.48
NR3C2 P08235 4/20 0.48
ITGB3 P05106 1/20 0.36
ITGAV P06756 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34

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
SCHEMBL3216794 0.82 NR3C1 (0.52) NR3C1PGRNR3C2L3MBTL1
SCHEMBL3223796 0.79 NR3C1 (0.56) NR3C1PGRNR3C2
SCHEMBL3223117 0.75 NR3C1 (0.68) NR3C1PGRNR3C2ITGB3ITGAV
SCHEMBL3219746 0.72 NR3C1 (0.50) NR3C1PGRNR3C2L3MBTL1
SCHEMBL3226726 0.69 NR3C1 (0.80) NR3C1PGRNR3C2
SCHEMBL3213631 0.69 NR3C1 (0.63) NR3C1PGRNR3C2L3MBTL1CYP3A4
SCHEMBL14044212 0.69 NR3C1 (0.44) NR3C1PGRNR3C2
SCHEMBL3224585 0.69 NR3C1 (0.48) NR3C1PGRNR3C2ITGB3ITGAV
SCHEMBL3226911 0.67 NR3C1 (0.52) NR3C1PGRNR3C2
SCHEMBL3220617 0.67 NR3C1 (0.44) NR3C1PGRNR3C2ITGAVCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2136811-A1 GLUCOCORTICOID MIMETICS, METHODS OF MAKING THEM, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF Boehringer Ingelheim International GmbH (DE) 2009-12-30 EP disclosed
WO-2008124745-A1 GLUCOCORTICOID MIMETICS, METHODS OF MAKING THEM, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-10-16 WO disclosed