SCHEMBL8022565

SCHEMBL8022565

CCC(=O)c1ccc(OCCCOc2ccc(OCC=C(Cl)Cl)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.52
L3MBTL1 Q9Y468 2/20 0.50
SMN1; SMN2 Q16637 4/20 0.48
MAPT P10636 4/20 0.48
RAB9A P51151 4/20 0.48
NPC1 O15118 3/20 0.48
HPGD P15428 1/20 0.48
GAA P10253 3/20 0.47
HRH2 P25021 1/20 0.46
HRH1 P35367 1/20 0.46
PLA2G4B P0C869 1/20 0.46
MMP1 P03956 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
HRH3 Q9Y5N1 2/20 0.44
ALDH1A1 P00352 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
SCHEMBL6549825 0.89 HTT (0.43) HTTL3MBTL1SMN1; SMN2MAPTRAB9A
SCHEMBL8021472 0.87 HTT (0.43) HTTL3MBTL1SMN1; SMN2MAPTRAB9A
SCHEMBL8022488 0.86 HTT (0.43) HTTL3MBTL1SMN1; SMN2MAPTRAB9A
SCHEMBL6640853 0.80 L3MBTL1 (0.60) HTTL3MBTL1SMN1; SMN2MAPTRAB9A
SCHEMBL10040898 0.80 L3MBTL1 (0.69) L3MBTL1SMN1; SMN2MAPTRAB9ANPC1
SCHEMBL20278587 0.80 GAA (0.67) HTTL3MBTL1SMN1; SMN2MAPTRAB9A
SCHEMBL17129733 0.79 L3MBTL1 (0.62) HTTL3MBTL1SMN1; SMN2MAPTRAB9A
SCHEMBL6549311 0.79 L3MBTL1 (0.50) HTTL3MBTL1SMN1; SMN2MAPTNPC1
SCHEMBL3969509 0.77 HTT (0.42) HTTL3MBTL1SMN1; SMN2MAPTRAB9A
SCHEMBL17002037 0.77 TP53 (0.70) L3MBTL1PLA2G4BMMP1

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-0975586-A2 OXIME COMPOUNDS, THEIR USE, AND INTERMEDIATES FOR THEIR PRODUCTION Sumitomo Chemical Company, Limited (JP) 2000-02-02 EP claimed
WO-1998045254-A2 OXIME COMPOUNDS, THEIR USE, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-10-15 WO claimed