SCHEMBL7076989

SCHEMBL7076989

COc1ccc(Oc2c(Br)cc(CO)cc2Br)cc1C(C)C

nearest known ligand 0.73

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
THRB P10828 16/20 0.73
RORC P51449 2/20 0.73
THRA P10827 14/20 0.55

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
SCHEMBL3886566 0.89 THRB (0.57) THRBRORCTHRA
SCHEMBL7071121 0.87 THRB (0.55) THRBRORCTHRA
SCHEMBL282819 0.85 THRB (0.74) THRBRORCTHRA
SCHEMBL5276573 0.85 THRB (0.74) THRBRORCTHRA
SCHEMBL282442 0.84 THRB (1.00) THRBRORCTHRA
SCHEMBL3160730 0.84 THRB (0.75) THRBRORCTHRA
SCHEMBL5618343 0.84 THRB (0.60) THRBRORCTHRA
SCHEMBL5283826 0.84 THRB (0.60) THRBRORCTHRA
SCHEMBL7073346 0.84 THRA (0.73) THRBTHRA
SCHEMBL8893247 0.83 THRB (0.57) THRBRORCTHRA

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-1000008-B1 NOVEL THYROID RECEPTOR LIGANDS AND METHOD KAROBIO AB (SE) 2003-06-25 EP disclosed
US-6465687-B1 SUBSTITUTED 4-HYDROXY-3-ALKYL- OR CYCLOALKYL-PHENOXYBENZENE COMPOUNDS SUCH AS 3,5-DIBROMO-4-(4-HYDROXY-3-ISOPROPYLPHENOXY)BENZOIC ACID, EXPRESSION INHIBITION OF A T3 REGULATED GENE KARO BIO AB (SE) 2002-10-15 US disclosed