SCHEMBL4440757

SCHEMBL4440757

Cc1cc(C)c(S(=O)(=O)NC(I)(COc2ccc(C)cc2Cl)C(F)(F)F)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 7/20 0.39
NR3C2 P08235 7/20 0.39
PGR P06401 5/20 0.39
ALDH1A1 P00352 1/20 0.37
PKM P14618 1/20 0.37
NPSR1 Q6W5P4 2/20 0.37
TSHR P16473 2/20 0.37
MAPK1 P28482 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2C19 P33261 2/20 0.36
CYP2D6 P10635 1/20 0.36
MAPT P10636 2/20 0.35
SLC40A1 Q9NP59 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MCL1 Q07820 1/20 0.35
RAB9A P51151 1/20 0.34
ATM Q13315 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
SCHEMBL4436562 0.94 NR3C1 (0.39) NR3C1NR3C2PGRALDH1A1NPSR1
SCHEMBL4437187 0.94 MEN1 (0.40) NR3C1NR3C2PGRALDH1A1NPSR1
SCHEMBL4440438 0.91 NR3C1 (0.41) NR3C1NR3C2PGRALDH1A1TSHR
SCHEMBL4442284 0.85 MEN1 (0.40) NR3C1NR3C2PGRTSHRMAPK1
SCHEMBL4439342 0.85 NR3C1 (0.39) NR3C1NR3C2PGRALDH1A1NPSR1
SCHEMBL4442338 0.83 NR3C1 (0.42) NR3C1NR3C2PGRTSHRMAPK1
SCHEMBL4439311 0.80 NR3C1 (0.43) NR3C1NR3C2PGRTSHRMAPK1
SCHEMBL4438824 0.80 NR3C1 (0.45) NR3C1NR3C2PGRALDH1A1TSHR
SCHEMBL4438774 0.80 NR3C1 (0.52) NR3C1NR3C2PGRTSHRMAPK1
SCHEMBL4439332 0.80 NR3C1 (0.43) NR3C1NR3C2PGRTSHRMAPK1

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