SCHEMBL5281234

SCHEMBL5281234

COC(=O)Cc1cc(Br)c(Oc2cc(C)c(O)c(C(C)C)c2)c(Br)c1

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
THRA P10827 18/20 0.70
THRB P10828 18/20 0.70
PPARG P37231 1/20 0.44

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
SCHEMBL5287547 0.88 THRB (0.73) THRATHRBPPARG
SCHEMBL5291080 0.85 THRA (0.54) THRATHRBPPARG
SCHEMBL5281119 0.84 THRA (0.83) THRATHRB
SCHEMBL5275174 0.84 THRA (0.59) THRATHRB
SCHEMBL4358728 0.83 THRA (1.00) THRATHRBPPARG
SCHEMBL5281917 0.82 THRA (0.78) THRATHRB
SCHEMBL5278045 0.81 THRB (0.48) THRATHRBPPARG
SCHEMBL5283381 0.81 THRA (0.52) THRATHRBPPARG
SCHEMBL5280888 0.81 THRA (0.57) THRATHRB
SCHEMBL5285435 0.81 THRA (0.50) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1862450-A2 Novel compounds KARO BIO AB (SE) 2007-12-05 EP disclosed
EP-1537073-B1 BENZAMIDE OR PHENYLACETAMIDE DERIVATIVES USEFUL AS THYROID RECEPTOR LIGANDS KAROBIO AB (SE) 2007-09-12 EP disclosed
EP-1537073-A2 BENZAMIDE OR PHENYLACETAMIDE DERIVATIVES USEFUL AS THYROID RECEPTOR LIGANDS KARO BIO AB (SE) 2005-06-08 EP disclosed
WO-2004007430-A2 BENZAMIDE OR PHENYLACETAMIDE DERIVATIVES USEFUL AS THYROID RECEPTOR LIGANDS KARO BIO AB (SE) 2004-01-22 WO disclosed