SCHEMBL10552467

SCHEMBL10552467

O/N=C1\COC2C(O)COC12.O/N=C1\COC2C(O)COC12

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.33

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
SCHEMBL10745265 0.77 THRB (0.31) THRBLMNA
SCHEMBL15218988 0.75 THRB (0.44) THRBLMNAMAPT
SCHEMBL196060 0.75 THRB (0.44) THRBLMNAMAPT
SCHEMBL10048336 0.75 THRB (0.44) THRBLMNAMAPT
SCHEMBL10016808 0.75 THRB (0.44) THRBLMNAMAPT
SCHEMBL1735065 0.75 THRB (0.44) THRBLMNAMAPT
SCHEMBL10747010 0.73 THRB (0.31) THRBLMNA
Isosorbide SCHEMBL699485 0.72 THRB (0.52) THRBLMNAMAPT
SCHEMBL10697714 0.71 CHRM2 (0.40)
SCHEMBL8293189 0.71 THRB (0.44) THRBLMNA

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-4883796-A Oxime ethers of 2,6-dioxabicyclo(3.3.0)octanones, and compositions and methods for treatment of a cardiac disease or circulatory with them HEINRICH MACK NACHF. (DE) 1989-11-28 US disclosed