SCHEMBL282636

SCHEMBL282636

Cc1ccc(C(=O)P(=O)(O)O)c(C)c1Cc1ccc(F)c(C(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
THRB P10828 14/20 0.44
THRA P10827 13/20 0.44
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
RXRA P19793 1/20 0.32

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
SCHEMBL283129 0.75 THRB (0.76) THRBTHRA
SCHEMBL328293 0.74 THRB (0.52) THRBTHRAPTGS1PTGS2
SCHEMBL13381667 0.74 THRB (0.49) THRBTHRA
SCHEMBL3748866 0.74 THRB (0.49) THRBTHRA
SCHEMBL13381666 0.73 THRB (0.65) THRBTHRA
SCHEMBL27733469 0.73 THRB (0.35) THRBTHRA
SCHEMBL282541 0.72 THRB (0.77) THRBTHRA
SCHEMBL282437 0.72 THRB (0.50) THRBTHRA
SCHEMBL13381655 0.71 THRB (0.65) THRBTHRA
SCHEMBL282457 0.70 THRB (0.43) THRBTHRA

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
EP-2428516-A1 Novel phosphorus-containing thyromimetics Metabasis Therapeutics, Inc. (US) 2012-03-14 EP disclosed