SCHEMBL16615635

SCHEMBL16615635

C=C(C)C(=O)OCCOC(=O)NCCO

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.50
CHRNB2 P17787 1/20 0.49
CHRNB4 P30926 1/20 0.49
CHRNA3 P32297 1/20 0.49
CHRNA4 P43681 1/20 0.49
ACHE P22303 14/20 0.47
TSHR P16473 3/20 0.44

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
SCHEMBL30488753 0.91 THRB (0.55) THRBACHETSHR
SCHEMBL13872030 0.89 THRB (0.53) THRBACHETSHR
SCHEMBL2403793 0.89 THRB (0.53) THRBACHETSHR
SCHEMBL10216111 0.88 ACHE (0.54) THRBCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL13872032 0.87 ACHE (0.58) THRBACHETSHR
SCHEMBL21404715 0.87 THRB (0.53) THRBCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL21404666 0.87 THRB (0.53) THRBCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL890335 0.86 ACHE (0.56) THRBCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL22035555 0.86 THRB (0.59) THRBACHETSHR
SCHEMBL275242 0.86 ACHE (0.56) THRBACHETSHR

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
WO-2015046313-A1 SOLID ELECTROLYTE COMPOSITION, BINDER FOR ALL-SOLID-STATE SECONDARY BATTERIES, AND ELECTRODE SHEET FOR BATTERIES AND ALL-SOLID-STATE SECONDARY BATTERY EACH USING SAID SOLID ELECTROLYTE COMPOSITION 富士フイルム株式会社 2015-04-02 WO disclosed