Ether

Ether

SCHEMBL9622535

C=COC(N)=O.CCOCC

nearest known ligand 0.42

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Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.42
ALDH1A1 P00352 3/20 0.37
TSHR P16473 3/20 0.37
THRB P10828 1/20 0.32
FGFR4 P22455 1/20 0.32

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
SCHEMBL35493 0.83
SCHEMBL28193582 0.80
Ether SCHEMBL404086 0.79 ALDH1A1 (0.43) ALDH1A1TSHRTHRB
Acetic Acid SCHEMBL8598465 0.78 FFAR3 (0.37) ALOX15ALDH1A1TSHRFGFR4
Ethylenediamine SCHEMBL3755114 0.78 TSHR (0.36) ALOX15ALDH1A1TSHRFGFR4
Acrylamide SCHEMBL7033416 0.78 ALDH1A1 (0.58) ALOX15ALDH1A1TSHRTHRBFGFR4
Acrylamide SCHEMBL10783907 0.78 ALDH1A1 (0.58) ALOX15ALDH1A1TSHRTHRBFGFR4
Ether SCHEMBL197072 0.77 ALDH1A1 (0.37) ALDH1A1TSHRTHRB
Ether SCHEMBL273352 0.77 TSHR (0.42) ALDH1A1TSHRTHRB
Butyric Acid SCHEMBL9170882 0.77 FFAR3 (0.52) ALOX15ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5159098-A Alk-1-enyloxy carbamates ISP INVESTMENTS INC. (US) 1992-10-27 US disclosed