SCHEMBL6668688

SCHEMBL6668688

COc1cccc(N2C(=O)C(C)(c3ccc(N4CCOCC4)cc3)NC2=S)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.49
HSD17B10 Q99714 2/20 0.49
GAA P10253 1/20 0.49
ALOX15 P16050 1/20 0.49
ALOX12 P18054 1/20 0.49
GSK3B P49841 1/20 0.46
HTR1A P08908 1/20 0.45
DRD2 P14416 1/20 0.45
HTR7 P34969 1/20 0.45
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 4/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
HPGD P15428 1/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
ADAM17 P78536 1/20 0.42
LMNA P02545 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL6629939 0.89 MAPT (0.50) MAPTGAAGSK3BALDH1A1KDM4E
SCHEMBL6625944 0.88 ALDH1A1 (0.48) MAPTHSD17B10GAAALOX15ALOX12
SCHEMBL6625470 0.88 MAPT (0.52) MAPTHSD17B10ALOX12ALDH1A1KDM4E
SCHEMBL6625004 0.87 GSK3B (0.45) MAPTHSD17B10GAAGSK3BALDH1A1
SCHEMBL6628598 0.87 MAPT (0.51) MAPTHTR1ADRD2HTR7ALDH1A1
SCHEMBL6625012 0.86 CNR1 (0.46) MAPTGAAALOX12HTR1ADRD2
SCHEMBL6626307 0.85 MAPT (0.52) MAPTHSD17B10GAAALOX15ALDH1A1
SCHEMBL6626132 0.85 ADAM17 (0.42) MAPTGAAALOX15GSK3BALDH1A1
SCHEMBL6625246 0.82 HTT (0.49) MAPTGAAALOX12ALDH1A1MEN1
SCHEMBL6626671 0.82 RAD51 (0.47) MAPTGAAHTR1ADRD2HTR7

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-1373219-A1 THIOHYDANTOINS AND USE THEREOF FOR TREATING DIABETES LABORATOIRES FOURNIER S.A. (FR) 2004-01-02 EP disclosed
WO-2002081453-A1 THIOHYDANTOINS AND USE THEREOF FOR TREATING DIABETES LABORATOIRES FOURNIER SA (FR) 2002-10-17 WO disclosed