SCHEMBL7074480

SCHEMBL7074480

COC(=O)C(CBr)c1ccc(Oc2ccc(OC)c(C(C)C)c2)c(Br)c1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RORC P51449 9/20 0.45
THRB P10828 6/20 0.45
THRA P10827 2/20 0.44
LPAR1 Q92633 3/20 0.38

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
SCHEMBL7069931 0.80 THRA (0.53) THRBTHRA
SCHEMBL7050847 0.77 THRB (0.54) RORCTHRBTHRA
SCHEMBL8047083 0.75 THRB (0.47) RORCTHRBTHRALPAR1
SCHEMBL31614252 0.73 ALDH1A1 (0.47)
SCHEMBL7069500 0.72 FOLH1 (0.50)
SCHEMBL5351651 0.72 THRB (0.53) RORCTHRBTHRA
SCHEMBL5363051 0.71 THRB (0.58) RORCTHRBTHRA
SCHEMBL7073270 0.71 RORC (0.52) RORCTHRBTHRA
SCHEMBL5355833 0.71 THRB (0.55) RORCTHRBTHRA
SCHEMBL8064359 0.70 RORC (0.43) RORCTHRBTHRALPAR1

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