Ether

Ether

SCHEMBL9560128

CCOCC.O=CN(CO)CO.O=CN(CO)CO

nearest known ligand 0.36

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Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
TSHR P16473 1/20 0.30

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 SCHEMBL9581644 1.00 ALDH1A1 (0.36) ALDH1A1TSHR
Methoxymethane SCHEMBL9582489 0.81 TSHR (0.30) TSHR
Methoxymethane SCHEMBL9700248 0.81 TSHR (0.30) TSHR
SCHEMBL9559964 0.81 TSHR (0.34) TSHR
SCHEMBL80952 0.81
Ether SCHEMBL8913501 0.77 TSHR (0.47) ALDH1A1TSHR
SCHEMBL2001818 0.76
Ether SCHEMBL18985182 0.75 TSHR (0.45) ALDH1A1TSHR
Di(Hydroxyethyl)Ether SCHEMBL9559927 0.75 TSHR (0.50) ALDH1A1TSHR
SCHEMBL7812396 0.74

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
EP-0553116-A1 PORPHYRIN DERIVATIVES QUEEN'S UNIVERSITY AT KINGSTON (CA) 1993-08-04 EP claimed
WO-1992006097-A1 PORPHYRIN DERIVATIVES QUEEN'S UNIVERSITY AT KINGSTON (CA) 1992-04-16 WO claimed
EP-0553116-A1 PORPHYRIN DERIVATIVES QUEEN'S UNIVERSITY AT KINGSTON (CA) 1993-08-04 EP disclosed
WO-1992006097-A1 PORPHYRIN DERIVATIVES QUEEN'S UNIVERSITY AT KINGSTON (CA) 1992-04-16 WO disclosed