Ether

Ether

SCHEMBL9470818

CCOCC.O/N=C\CCOc1ccc(Cc2ccccc2)cc1Cl

nearest known ligand 0.49

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.49
SMN1; SMN2 Q16637 4/20 0.44
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
CSNK2A1 P68400 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ATM Q13315 2/20 0.38
MAPT P10636 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
LTB4R Q15722 2/20 0.38
LTB4R2 Q9NPC1 2/20 0.38
GLA P06280 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
Ether SCHEMBL9470837 1.00 LTA4H (0.49) LTA4HSMN1; SMN2RAB9ANPC1NFKB1
Ether SCHEMBL9470311 0.89 CYP1A2 (0.40) LTA4HSMN1; SMN2RAB9ANPC1NFKB1
Ether SCHEMBL9470295 0.89 CYP1A2 (0.40) LTA4HSMN1; SMN2RAB9ANPC1NFKB1
Ether SCHEMBL9470960 0.87 CSNK2A1 (0.39) LTA4HSMN1; SMN2CSNK2A1ATMGLA
Ether SCHEMBL9470947 0.87 CSNK2A1 (0.39) LTA4HSMN1; SMN2CSNK2A1ATMGLA
SCHEMBL9470824 0.84 LTA4H (0.51) LTA4HSMN1; SMN2RAB9ANPC1NFKB1
SCHEMBL9471556 0.81 MAPT (0.44) LTA4HSMN1; SMN2RAB9ANPC1NFKB1
SCHEMBL9471559 0.81 MAPT (0.44) LTA4HSMN1; SMN2RAB9ANPC1NFKB1
SCHEMBL9470832 0.79 LTA4H (0.51) LTA4HSMN1; SMN2RAB9ANPC1NFKB1
SCHEMBL9471560 0.78 MAPT (0.43) LTA4HSMN1; SMN2RAB9ANPC1NFKB1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5232949-A Insecticides, miticides; potentiation SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-08-03 US claimed
EP-0514831-A2 3-(4-Substituted-2-chlorophenoxy)propionaldoxime ethyl ether compounds, their production processes and their compositions for the control of insect pests SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-11-25 EP claimed
US-5232949-A Insecticides, miticides; potentiation SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-08-03 US disclosed
EP-0514831-A2 3-(4-Substituted-2-chlorophenoxy)propionaldoxime ethyl ether compounds, their production processes and their compositions for the control of insect pests SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-11-25 EP disclosed