SCHEMBL4648510

SCHEMBL4648510

O=C(C=COc1ccccc1)Nc1ccc(C(=O)c2ccccc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.66
MAPT P10636 5/20 0.66
MEN1 O00255 3/20 0.66
KMT2A Q03164 3/20 0.66
RAB9A P51151 4/20 0.53
NPC1 O15118 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.51
FFAR1 O14842 1/20 0.49
HPGD P15428 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
HTT P42858 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
MAPK13 O15264 1/20 0.47
MAPK12 P53778 1/20 0.47
MAPK11 Q15759 1/20 0.47
MAPK14 Q16539 1/20 0.47
HIF1A Q16665 2/20 0.47
TGM2 P21980 1/20 0.47
LPAR1 Q92633 1/20 0.46
LPAR2 Q9HBW0 1/20 0.46

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
SCHEMBL4645874 0.88 ALDH1A1 (0.57) ALDH1A1MAPTRAB9ANPC1L3MBTL1
SCHEMBL4647932 0.87 MAPT (0.54) ALDH1A1MAPTMEN1KMT2ARAB9A
SCHEMBL4647079 0.87 MAPT (0.54) ALDH1A1MAPTMEN1KMT2ARAB9A
SCHEMBL4644760 0.84 ALDH1A1 (0.54) ALDH1A1MAPTMEN1KMT2ARAB9A
SCHEMBL4645027 0.84 MMP1 (0.61) ALDH1A1MAPTMEN1KMT2ARAB9A
SCHEMBL4648924 0.84 ALDH1A1 (0.58) ALDH1A1MAPTMEN1KMT2ARAB9A
SCHEMBL4648316 0.84 MMP1 (0.61) ALDH1A1MAPTMEN1KMT2ARAB9A
SCHEMBL4646849 0.82 MMP1 (0.68) ALDH1A1MAPTMEN1KMT2ARAB9A
SCHEMBL4649121 0.81 ALDH1A1 (0.51) ALDH1A1MAPTMEN1KMT2ARAB9A
SCHEMBL4648216 0.81 ALDH1A1 (0.52) ALDH1A1MAPTRAB9ANPC1L3MBTL1

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-1957459-A2 IMINOPROPENE COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2008-08-20 EP disclosed
WO-2007063702-A2 IMINOPROPENE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-06-07 WO disclosed