SCHEMBL4352291

SCHEMBL4352291

CC(C)C(=O)Nc1ccc(Oc2c(Cl)cc(CC(=O)N(CI)C(C)C(=O)O)cc2Cl)cc1Br

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
THRB P10828 18/20 0.73
THRA P10827 15/20 0.73
RORC P51449 3/20 0.40
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL5390894 0.89 THRB (0.75) THRBTHRARORC
SCHEMBL4566353 0.89 THRB (0.56) THRBTHRARORC
SCHEMBL5392866 0.85 THRA (1.00) THRBTHRA
SCHEMBL5396339 0.84 THRB (0.79) THRBTHRARORC
SCHEMBL5385245 0.82 THRB (0.82) THRBTHRARORCKDM4E
SCHEMBL5382651 0.81 THRB (0.78) THRBTHRARORCKDM4E
SCHEMBL4524227 0.81 THRB (0.77) THRBTHRARORC
SCHEMBL7204449 0.80 THRB (0.75) THRBTHRARORCKDM4E
SCHEMBL5387224 0.80 THRB (0.81) THRBTHRARORC
SCHEMBL5388459 0.79 THRB (0.81) THRBTHRARORC

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-2009080835-A1 THYROMIMETRIC COMPOUNDS IN TREATMENT OF DISEASE RELATED TO SONIC HEDGEHOG SIGNALLING KARO BIO AB (SE) 2009-07-02 WO claimed