SCHEMBL7051707

SCHEMBL7051707

COc1cc(C(=O)c2ccc(Cl)cc2)c(Oc2c(Br)cc(CC(=O)O)cc2Br)cc1C(C)C

nearest known ligand 0.74

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.74
THRB P10828 16/20 0.48
THRA P10827 15/20 0.48
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.39

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
SCHEMBL7687151 0.91 NR3C1 (0.62) NR3C1THRBTHRAPOLBMAPT
SCHEMBL7054870 0.91 NR3C1 (0.81) NR3C1THRBTHRA
SCHEMBL7052325 0.91 NR3C1 (0.84) NR3C1THRBTHRA
SCHEMBL7052047 0.90 NR3C1 (0.74) NR3C1THRBTHRAMAPT
SCHEMBL7054052 0.90 NR3C1 (0.74) NR3C1THRBTHRA
SCHEMBL7054486 0.90 NR3C1 (0.82) NR3C1THRBTHRA
SCHEMBL7053492 0.89 NR3C1 (0.58) NR3C1THRBTHRAPOLBMAPT
SCHEMBL7256429 0.87 NR3C1 (0.75) NR3C1THRBTHRA
SCHEMBL7253471 0.86 NR3C1 (0.82) NR3C1THRBTHRA
SCHEMBL7054470 0.86 NR3C1 (0.84) NR3C1THRBTHRA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1102739-B1 GLUCOCORTICOID AND THYROID HORMONE RECEPTOR LIGANDS FOR THE TREATMENT OF METABOLIC DISORDERS KAROBIO AB (SE) 2003-04-23 EP claimed
US-6492424-B1 Glucocorticoid and thyroid hormone receptor ligands for the treatment of metabolic disorders KARO BIO AB (SE) 2002-12-10 US claimed
US-6492424-B1 Glucocorticoid and thyroid hormone receptor ligands for the treatment of metabolic disorders KARO BIO AB (SE) 2002-12-10 US disclosed