SCHEMBL2265672

SCHEMBL2265672

CCOC(CN(N)CC(F)F)OCC

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.31

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
SCHEMBL412250 0.66 THRB (0.40) THRB
SCHEMBL224287 0.66 THRB (0.40) THRB
SCHEMBL441769 0.64 THRB (0.38) THRB
SCHEMBL29883163 0.64 THRB (0.38) THRB
SCHEMBL3558295 0.63
SCHEMBL11252538 0.62 LMNA (0.41) THRB
SCHEMBL9138516 0.62 THRB (0.36) THRB
SCHEMBL11260144 0.61 THRB (0.35) THRB
SCHEMBL27803886 0.59 THRB (0.44) THRB
SCHEMBL289118 0.59

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-7994168-B2 Hexahydro-pyrazino[1,2-A]pyrimidine-4,7-dione derivatives substituted with amino acids SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2011-08-09 US disclosed