Ether

Ether

SCHEMBL7157288

C=CCOC(O)C=C.CCOCC

nearest known ligand 0.35

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Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
POLB P06746 1/20 0.31
ALDH1A1 P00352 2/20 0.31
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
SCHEMBL87560 0.87
Ammonia Solution, Strong SCHEMBL18689906 0.84
Ether SCHEMBL28837459 0.79 TSHR (0.37) CA1CA2CA7MEN1KMT2A
SCHEMBL1978240 0.77
SCHEMBL12231853 0.77 ALDH1A1 (0.42) ALDH1A1TSHR
SCHEMBL23694376 0.75 ALDH1A1 (0.41) ALDH1A1TSHR
Ether SCHEMBL7165650 0.74 ALDH1A1 (0.35) CA1CA2CA7ALDH1A1TSHR
Ether SCHEMBL11286810 0.72 CA1 (0.61) CA1CA2CA7MEN1KMT2A
Ether SCHEMBL3258161 0.71 MEN1 (0.46) CA1CA2CA7MEN1KMT2A
SCHEMBL8524325 0.71 THRB (0.33)

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
JP-2003074000-A PAPER-PLASTIC COMPLEX STRUCTURE FUJI PHOTO FILM CO LTD 2003-03-12 JP disclosed