SCHEMBL4436686

SCHEMBL4436686

CCc1ccc(C(S)C(NS(=O)(=O)c2c(C)cc(C)cc2C)C(F)(F)F)cc1

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 20/20 0.48
NR3C2 P08235 18/20 0.48
PGR P06401 15/20 0.48

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
SCHEMBL4436716 0.85 NR3C1 (0.46) NR3C1NR3C2PGR
SCHEMBL4435058 0.85 NR3C1 (0.46) NR3C1NR3C2PGR
SCHEMBL4440564 0.85 NR3C1 (0.46) NR3C1NR3C2PGR
SCHEMBL4442395 0.84 NR3C1 (0.47) NR3C1NR3C2PGR
SCHEMBL4438783 0.83 NR3C1 (0.48) NR3C1NR3C2PGR
SCHEMBL4441939 0.81 NR3C1 (0.51) NR3C1NR3C2PGR
SCHEMBL4435062 0.81 NR3C1 (0.45) NR3C1NR3C2PGR
SCHEMBL4440922 0.79 NR3C1 (0.43) NR3C1NR3C2PGR
SCHEMBL4439562 0.79 NR3C1 (0.47) NR3C1NR3C2PGR
SCHEMBL4442287 0.79 NR3C1 (0.49) NR3C1NR3C2PGR

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