SCHEMBL6701909

SCHEMBL6701909

COc1cccc(N2C(=O)C(C)N(c3ccc(N4CCOCC4)cc3)C2=S)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.59
HSD17B10 Q99714 3/20 0.59
GAA P10253 3/20 0.59
ALOX15 P16050 3/20 0.59
ALOX12 P18054 1/20 0.59
KMT2A Q03164 5/20 0.51
ALDH1A1 P00352 8/20 0.46
MEN1 O00255 4/20 0.46
KDM4E B2RXH2 2/20 0.46
POLB P06746 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
FAAH O00519 1/20 0.46
LMNA P02545 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
HPGD P15428 1/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
KIF11 P52732 1/20 0.44
CNR1 P21554 1/20 0.44

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
SCHEMBL6703990 0.89 ALDH1A1 (0.51) MAPTHSD17B10GAAALOX15ALOX12
SCHEMBL6648013 0.88 GAA (0.46) MAPTHSD17B10GAAALOX15ALOX12
SCHEMBL6704444 0.87 ALDH1A1 (0.51) MAPTHSD17B10GAAALOX15ALOX12
SCHEMBL6703155 0.87 ALDH1A1 (0.52) MAPTHSD17B10GAAALOX15ALOX12
SCHEMBL6705427 0.86 MAPT (0.51) MAPTHSD17B10GAAALOX15ALOX12
SCHEMBL6703684 0.86 ALDH1A1 (0.46) MAPTHSD17B10GAAALOX15ALOX12
SCHEMBL6704097 0.85 KIF11 (0.53) MAPTGAAALOX15ALOX12KMT2A
SCHEMBL6702824 0.85 KIF11 (0.53) MAPTGAAALOX15ALOX12KMT2A
SCHEMBL6702569 0.84 MAPT (0.49) MAPTHSD17B10GAAALOX15ALOX12
SCHEMBL6705000 0.84 MAPT (0.61) MAPTHSD17B10GAAALOX15ALOX12

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
US-20040116417-A1 Thiohydantoins and use thereof for treating diabetes LABORATOIRES FOURNIER SA (FR) 2004-06-17 US disclosed