SCHEMBL4356506

SCHEMBL4356506

CC(C)c1cc(Oc2c(Br)cc(CC(=O)N(CI)C(C)C(=O)O)cc2Br)ccc1O

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
THRA P10827 16/20 0.69
THRB P10828 16/20 0.69

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
SCHEMBL4566518 0.87 THRA (0.72) THRATHRB
SCHEMBL7955376 0.87 THRA (0.72) THRATHRB
SCHEMBL4355360 0.82 THRA (0.65) THRATHRB
SCHEMBL4352011 0.82 THRA (1.00) THRATHRB
SCHEMBL7953358 0.80 THRA (0.62) THRATHRB
SCHEMBL4566482 0.79 THRA (0.66) THRATHRB
SCHEMBL4566483 0.79 THRA (0.66) THRATHRB
SCHEMBL4560603 0.79 THRA (0.66) THRATHRB
SCHEMBL5619283 0.79 THRA (0.80) THRATHRB
SCHEMBL4360381 0.79 THRA (1.00) 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 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 disclosed