SCHEMBL4009963

SCHEMBL4009963

CCOC(=O)c1csc2c1CCOC2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.46
TDP1 Q9NUW8 2/20 0.46
TP53 P04637 2/20 0.46
HPGD P15428 5/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
THRB P10828 1/20 0.44
ALDH1A1 P00352 5/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
MAPK1 P28482 3/20 0.40
GAA P10253 3/20 0.40
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
ABCB1 P08183 1/20 0.39
HSD17B10 Q99714 3/20 0.38
ALOX15 P16050 2/20 0.38
KDM4E B2RXH2 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
USP2 O75604 1/20 0.38
NPSR1 Q6W5P4 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
SCHEMBL13768422 0.89 MAPT (0.46) MAPTTDP1TP53HPGDL3MBTL1
SCHEMBL1379362 0.80 MAPT (0.65) MAPTTDP1TP53HPGDL3MBTL1
SCHEMBL5260554 0.80 MAPT (0.62) MAPTTDP1TP53HPGDL3MBTL1
SCHEMBL23833453 0.78 MAPT (0.66) MAPTTDP1TP53HPGDL3MBTL1
SCHEMBL5837033 0.77 PTPRC (0.42) MAPTHPGDL3MBTL1ALDH1A1MEN1
SCHEMBL3647943 0.76 CFTR (0.40) MAPTHPGDL3MBTL1ALDH1A1MEN1
SCHEMBL31564318 0.76 MAPT (0.46) MAPTTDP1TP53HPGDL3MBTL1
SCHEMBL1425934 0.76 ADORA1 (0.50) MAPTTDP1TP53HPGDL3MBTL1
SCHEMBL13768306 0.76 L3MBTL1 (0.43) MAPTTDP1TP53HPGDL3MBTL1
SCHEMBL31564015 0.76 GABRP (0.51) MAPTTDP1TP53HPGDL3MBTL1

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
WO-2009085256-A1 ANTI-HIV COMPOUNDS PANACOS PHARMACEUTICALS, INC. (US) 2009-07-09 WO disclosed
WO-2009085256-A1 ANTI-HIV COMPOUNDS PANACOS PHARMACEUTICALS, INC. (US) 2009-07-09 WO disclosed