SCHEMBL4370085

SCHEMBL4370085

CCOc1ccc(-n2[nH]c(=O)c3cc(NS(=O)(=O)c4cccc(Cl)c4C)ccc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.42
ALDH1A1 P00352 5/20 0.42
MAPT P10636 4/20 0.42
HTT P42858 3/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
GAA P10253 1/20 0.42
HIF1A Q16665 1/20 0.41
LMNA P02545 6/20 0.41
NPSR1 Q6W5P4 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
HPGD P15428 2/20 0.40
GSPT1 P15170 1/20 0.40
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 1/20 0.40
POLB P06746 2/20 0.39
NR1I2 O75469 1/20 0.39
BRD4 O60885 1/20 0.39
PKM P14618 1/20 0.38

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
SCHEMBL5615200 0.87 GSPT1 (0.47) MAPTMEN1KMT2AHIF1ALMNA
SCHEMBL4363789 0.87 ALDH1A1 (0.53) ALDH1A1MAPTHTTMEN1KMT2A
SCHEMBL4362689 0.83 POLB (0.48) ALOX15ALDH1A1MAPTHTTMEN1
SCHEMBL3906958 0.80 LMNA (0.46) ALDH1A1MAPTMEN1KMT2AHIF1A
SCHEMBL4359570 0.78 NR3C1 (0.48) ALOX15ALDH1A1MAPTHTTMEN1
SCHEMBL3917157 0.76 GSPT1 (0.42) ALDH1A1MAPTMEN1KMT2AHIF1A
SCHEMBL3903016 0.76 NR1I2 (0.48) ALDH1A1MAPTMEN1KMT2AHIF1A
SCHEMBL1811055 0.76 GSPT1 (0.45) ALDH1A1MAPTMEN1KMT2AHIF1A
SCHEMBL3913044 0.76 BRD4 (0.46) NR1I2BRD4
SCHEMBL3906772 0.75 GSPT1 (0.43) ALDH1A1MAPTMEN1KMT2AHIF1A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1797042-B1 INDOZOLONE DERIVATIVES AS 11B-HSD1 INHIBITORS HOFFMANN LA ROCHE (CH) 2009-01-07 EP claimed