SCHEMBL4442292

SCHEMBL4442292

Cc1cc(C)c(S(=O)(=O)NC(I)(CSc2cc(Cl)ccc2Cl)C(F)(F)F)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 4/20 0.38
PGR P06401 4/20 0.38
NR3C2 P08235 4/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
CA1 P00915 2/20 0.37
CCR2 P41597 6/20 0.36
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2C19 P33261 2/20 0.35
CYP2D6 P10635 1/20 0.35
TSHR P16473 1/20 0.35
MAPT P10636 2/20 0.34
MAPK1 P28482 1/20 0.34
POLB P06746 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
EPHX2 P34913 1/20 0.34
CA2 P00918 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33

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
SCHEMBL4444804 0.92 NR3C1 (0.38) NR3C1PGRNR3C2MEN1KMT2A
SCHEMBL4437844 0.88 NR3C1 (0.43) NR3C1PGRNR3C2MEN1KMT2A
SCHEMBL4439570 0.86 NR3C1 (0.45) NR3C1PGRNR3C2MEN1KMT2A
SCHEMBL4440436 0.84 NR3C1 (0.40) NR3C1PGRNR3C2MEN1KMT2A
SCHEMBL4435000 0.84 NR3C1 (0.38) NR3C1PGRNR3C2MEN1KMT2A
SCHEMBL4436592 0.83 NR3C1 (0.41) NR3C1PGRNR3C2MEN1KMT2A
SCHEMBL4446762 0.83 NR3C1 (0.45) NR3C1PGRNR3C2MEN1KMT2A
SCHEMBL4436507 0.83 NR3C1 (0.42) NR3C1PGRNR3C2MEN1KMT2A
SCHEMBL4440638 0.82 NR3C1 (0.41) NR3C1PGRNR3C2MEN1KMT2A
SCHEMBL4442446 0.82 NR3C1 (0.40) NR3C1PGRNR3C2MEN1KMT2A

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