SCHEMBL4436562

SCHEMBL4436562

Cc1cc(C)c(S(=O)(=O)NC(I)(COc2cc(C)ccc2Cl)C(F)(F)F)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 8/20 0.39
NR3C2 P08235 7/20 0.39
PGR P06401 5/20 0.39
MAPT P10636 3/20 0.38
LMNA P02545 2/20 0.38
GAA P10253 1/20 0.38
XBP1 P17861 1/20 0.38
FFAR4 Q5NUL3 1/20 0.37
MCL1 Q07820 1/20 0.37
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
CYP2C19 P33261 3/20 0.36
MAPK1 P28482 3/20 0.36
NPSR1 Q6W5P4 2/20 0.36
ALDH1A1 P00352 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
USP2 O75604 1/20 0.36
POLB P06746 1/20 0.36
CYP2C9 P11712 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL4440757 0.94 NR3C1 (0.39) NR3C1NR3C2PGRMAPTMCL1
SCHEMBL4437187 0.89 MEN1 (0.40) NR3C1NR3C2PGRMAPTMEN1
SCHEMBL4440438 0.89 NR3C1 (0.41) NR3C1NR3C2PGRMAPTMEN1
SCHEMBL4442284 0.85 MEN1 (0.40) NR3C1NR3C2PGRMAPTFFAR4
SCHEMBL4442338 0.83 NR3C1 (0.42) NR3C1NR3C2PGRMAPTLMNA
SCHEMBL4439311 0.80 NR3C1 (0.43) NR3C1NR3C2PGRMAPTLMNA
SCHEMBL4439342 0.80 NR3C1 (0.39) NR3C1NR3C2PGRMAPTLMNA
SCHEMBL4438774 0.80 NR3C1 (0.52) NR3C1NR3C2PGRMAPTLMNA
SCHEMBL4439332 0.80 NR3C1 (0.43) NR3C1NR3C2PGRMAPTLMNA
SCHEMBL4441148 0.80 NR3C1 (0.45) NR3C1NR3C2PGRMAPTLMNA

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