SCHEMBL4441966

SCHEMBL4441966

Cc1cc(C)c(S(=O)(=O)NCCCCSc2ccccc2)c(C)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.59
FABP4 P15090 1/20 0.58
NR3C1 P04150 1/20 0.53
PGR P06401 1/20 0.53
NR3C2 P08235 1/20 0.53
ALDH1A1 P00352 5/20 0.48
MAPT P10636 4/20 0.48
CNR2 P34972 1/20 0.48
GAA P10253 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
FGB P02675 1/20 0.47
POLB P06746 1/20 0.47
ALOX12 P18054 1/20 0.46
LMNA P02545 2/20 0.45
TSHR P16473 1/20 0.45
HSD17B10 Q99714 1/20 0.45
NR2F2 P24468 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL4446865 0.86 L3MBTL1 (0.54) L3MBTL1FABP4NR3C1PGRNR3C2
SCHEMBL5963342 0.81 FABP4 (0.76) L3MBTL1FABP4MAPTGAAMEN1
SCHEMBL4440730 0.80 L3MBTL1 (0.60) L3MBTL1FABP4NR3C1PGRNR3C2
SCHEMBL4448257 0.80 L3MBTL1 (0.63) L3MBTL1FABP4NR3C1PGRNR3C2
SCHEMBL11560895 0.79 FABP4 (0.61) L3MBTL1FABP4MAPTGAAMEN1
SCHEMBL11495820 0.78 FABP4 (0.59) L3MBTL1FABP4MAPTGAAMEN1
SCHEMBL4514428 0.78 L3MBTL1 (0.83) L3MBTL1FABP4NR3C1ALDH1A1MAPT
SCHEMBL4436503 0.76 L3MBTL1 (0.56) L3MBTL1FABP4NR3C1ALDH1A1MAPT
SCHEMBL4441202 0.76 L3MBTL1 (0.58) L3MBTL1FABP4NR3C1PGRNR3C2
SCHEMBL4746858 0.75 FABP4 (0.68) L3MBTL1FABP4MAPTGAAMEN1

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