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Sugi Predict / Compounds / SCHEMBL7073261

SCHEMBL7073261

SCHEMBL7073261

COc1ccc(Oc2c(Cl)cc(C(C)C(=O)O)cc2Cl)cc1C(C)C

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 10/20 0.65
▸ THRB P10828 9/20 0.65
▸ THRA P10827 4/20 0.53
▸ AKR1C3 P42330 1/20 0.44
▸ AKR1C2 P52895 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
SCHEMBL282237 0.88 THRB (0.51) RORCTHRBTHRAAKR1C3AKR1C2
SCHEMBL5363051 0.85 THRB (0.58) RORCTHRBTHRA
SCHEMBL5619231 0.85 THRB (0.73) RORCTHRBTHRA
SCHEMBL7069850 0.85 THRA (0.73) THRBTHRA
SCHEMBL8902087 0.82 THRB (0.65) RORCTHRBTHRA
SCHEMBL282476 0.81 RORC (0.66) RORCTHRBTHRA
SCHEMBL7073265 0.80 THRB (0.76) RORCTHRBTHRA
SCHEMBL22959162 0.80 RORC (0.70) RORCTHRBTHRA
SCHEMBL22959176 0.80 RORC (0.70) RORCTHRBTHRA
SCHEMBL22959261 0.79 THRB (0.70) RORCTHRBTHRA

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