SCHEMBL5690281

SCHEMBL5690281

CC(=O)C(=O)c1ccc(OCCCOc2c(Cl)cc(OCC=C(Cl)Cl)cc2Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.40
GAA P10253 1/20 0.40
PLA2G4B P0C869 1/20 0.36
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
DPP4 P27487 1/20 0.35
FFAR1 O14842 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
MAPT P10636 1/20 0.34
PLAU P00749 1/20 0.34
TP53 P04637 1/20 0.34
TSHR P16473 1/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34

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
SCHEMBL6547877 0.92 L3MBTL1 (0.51) HTTL3MBTL1GAAPOLBFFAR1
SCHEMBL6548648 0.89 L3MBTL1 (0.55) HTTL3MBTL1GAAPOLBAPEX1
SCHEMBL6549409 0.88 GAA (0.56) HTTL3MBTL1GAAPLA2G4BPOLB
SCHEMBL8894826 0.88 PLA2G4B (0.46) HTTL3MBTL1PLA2G4BPOLBAPEX1
SCHEMBL6547959 0.88 HTT (0.49) HTTL3MBTL1GAAPOLBMAPT
SCHEMBL3963156 0.88 HTT (0.43) HTTL3MBTL1GAAPLA2G4BPOLB
SCHEMBL3963155 0.88 HTT (0.43) HTTL3MBTL1GAAPLA2G4BPOLB
SCHEMBL6549825 0.87 HTT (0.43) HTTL3MBTL1GAAPLA2G4BMAPT
SCHEMBL8660004 0.87 MAPT (0.51) HTTL3MBTL1GAAPOLBTDP1
SCHEMBL13606721 0.86 HTT (0.41) HTTL3MBTL1GAAPLA2G4BPOLB

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-1638924-A1 PESTICIDALLY ACTIVE KETONE AND OXIME DERIVATIVES Syngenta Participations AG (CH) 2006-03-29 EP disclosed
WO-2004113273-A1 PESTICIDALLY ACTIVE KETONE AND OXIME DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2004-12-29 WO disclosed