SCHEMBL5608331

SCHEMBL5608331

Cc1c(Cl)cccc1S(=O)(=O)Nc1ccc2[nH]n(CC3CC3)c(=O)c2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSPT1 P15170 1/20 0.48
DDB1 Q16531 1/20 0.48
CRBN Q96SW2 1/20 0.48
HTR6 P50406 7/20 0.45
HTR1A P08908 2/20 0.43
HTR1B P28222 2/20 0.43
HTR2C P28335 2/20 0.43
HTR1F P30939 2/20 0.43
HTR1D P28221 1/20 0.43
HTR2A P28223 1/20 0.43
HTR7 P34969 1/20 0.43
BRD4 O60885 2/20 0.43
GHSR Q92847 1/20 0.40
HSD11B1 P28845 1/20 0.38
HIF1A Q16665 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SLC40A1 Q9NP59 1/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL5608793 0.86 PKM (0.41) HTR6HTR1AHTR1BHTR2CHTR1F
SCHEMBL3906300 0.85 GSPT1 (0.48) GSPT1DDB1CRBNHTR6HTR1A
SCHEMBL5608712 0.83 BRD4 (0.46) GSPT1DDB1CRBNHTR6HTR1A
SCHEMBL5608726 0.82 BRD4 (0.53) DDB1CRBNHTR6HTR1AHTR1B
SCHEMBL1802901 0.81 BRD4 (0.41) GSPT1DDB1CRBNHTR6HTR1A
SCHEMBL5608971 0.78 PKM (0.46) HTR6HTR2CHTR2ABRD4MEN1
SCHEMBL3906958 0.73 LMNA (0.46) GSPT1DDB1CRBNHTR6BRD4
SCHEMBL618067 0.73 BRD4 (0.56) GSPT1DDB1CRBNHTR6BRD4
SCHEMBL3903016 0.71 NR1I2 (0.48) GSPT1DDB1CRBNBRD4HSD11B1
SCHEMBL5609008 0.71 BRD4 (0.38) HTR6HTR1AHTR1BHTR2CHTR1F

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-1797042-A1 INDOZOLONE DERIVATIVES AS 11B-HSD1 INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2007-06-20 EP disclosed
WO-2006034804-A1 INDOZOLONE DERIVATIVES AS 11B-HSD1 INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2006-04-06 WO disclosed