Ether

Ether

SCHEMBL9503116

C=CCOS(=O)(=O)Oc1ccccc1.CCOCC.N

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
CA9 Q16790 3/20 0.36
KMT2A Q03164 4/20 0.36
PPARG P37231 4/20 0.34
LMNA P02545 2/20 0.34
NFE2L2 Q16236 2/20 0.34
MEN1 O00255 3/20 0.33
CA12 O43570 1/20 0.33
CA7 P43166 1/20 0.33
CYP3A4 P08684 1/20 0.32
PKM P14618 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HTT P42858 1/20 0.31
LTA4H P09960 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
PTPRC P08575 1/20 0.31

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 SCHEMBL432915 0.98 CA1 (0.37) CA1CA2CA9KMT2APPARG
Ether SCHEMBL9350029 0.97 CA1 (0.36) CA1CA2CA9KMT2APPARG
Ether SCHEMBL2938995 0.97 CA1 (0.36) CA1CA2CA9KMT2APPARG
Ether SCHEMBL8520419 0.92 KMT2A (0.33) CA1CA2CA9KMT2APPARG
SCHEMBL174593 0.89 CA1 (0.44) CA1CA2CA9KMT2APPARG
SCHEMBL28600708 0.88 CA1 (0.42) CA1CA2CA9KMT2APPARG
SCHEMBL28317038 0.88 CA1 (0.42) CA1CA2CA9KMT2APPARG
Ether SCHEMBL8670284 0.84 MEN1 (0.32) CA1CA2CA9KMT2ALMNA
SCHEMBL15468128 0.81 CA1 (0.40) CA1CA2CA9KMT2APPARG
Ether SCHEMBL23581122 0.81 CA1 (0.48) CA1CA2CA9KMT2APPARG

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
JP-5139915-A None JP disclosed
JP-H05139915-A AQUEOUS SUSPENDED HERBICIDAL FORMULATION COMPOSITION MITSUBISHI PETROCHEM CO LTD 1993-06-08 JP disclosed