SCHEMBL4980997

SCHEMBL4980997

CC(C)c1cc(Cc2c(S(C)(=O)=O)cc(OCP(=O)(O)O)cc2S(C)(=O)=O)ccc1O

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
THRA P10827 20/20 0.72
THRB P10828 20/20 0.72

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
Mb07344 SCHEMBL282003 0.84 THRB (1.00) THRATHRB
Mb07344 SCHEMBL29378732 0.84 THRB (1.00) THRATHRB
SCHEMBL21291168 0.83 THRA (0.78) THRATHRB
SCHEMBL328320 0.83 THRA (0.77) THRATHRB
SCHEMBL328469 0.82 THRA (1.00) THRATHRB
SCHEMBL13946957 0.80 THRB (0.85) THRATHRB
SCHEMBL3147737 0.79 THRB (0.74) THRATHRB
SCHEMBL3160842 0.76 THRB (0.85) THRATHRB
SCHEMBL282073 0.76 THRB (1.00) THRATHRB
SCHEMBL13381899 0.76 THRA (0.76) THRATHRB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1890768-A2 NOVEL PHOSPHINIC ACID-CONTAINING THYROMIMETICS Metabasis Therapeutics, Inc. (US) 2008-02-27 EP disclosed
WO-2006128056-A2 NOVEL PHOSPHINIC ACID-CONTAINING THYROMIMETICS METABASIS THERAPEUTICS, INC. (US) 2006-11-30 WO disclosed