SCHEMBL7051598

SCHEMBL7051598

COC(=O)Cc1cc(Br)c(Oc2cc(C(C)C)c(OC)cc2C(=O)CC(C)(C)C)c(Br)c1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.53
THRA P10827 15/20 0.39
THRB P10828 15/20 0.39
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL7052346 0.91 NR3C1 (0.64) NR3C1THRATHRBALOX15TSHR
SCHEMBL7254981 0.86 NR3C1 (0.57) NR3C1THRATHRBALOX15TSHR
SCHEMBL7252423 0.85 NR3C1 (0.52) NR3C1THRATHRBTSHRHSD17B10
SCHEMBL7052393 0.84 NR3C1 (0.51) NR3C1THRATHRB
SCHEMBL7051600 0.83 NR3C1 (0.53) NR3C1THRATHRB
SCHEMBL7051558 0.83 NR3C1 (0.59) NR3C1THRATHRB
SCHEMBL7251618 0.82 NR3C1 (0.52) NR3C1THRATHRBALOX15TSHR
SCHEMBL7256183 0.81 NR3C1 (0.69) NR3C1THRATHRBALOX15TSHR
SCHEMBL7053515 0.81 NR3C1 (0.72) NR3C1THRATHRB
SCHEMBL7053915 0.80 NR3C1 (0.61) NR3C1THRATHRB

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-1102739-B1 GLUCOCORTICOID AND THYROID HORMONE RECEPTOR LIGANDS FOR THE TREATMENT OF METABOLIC DISORDERS KAROBIO AB (SE) 2003-04-23 EP disclosed
US-6492424-B1 Glucocorticoid and thyroid hormone receptor ligands for the treatment of metabolic disorders KARO BIO AB (SE) 2002-12-10 US disclosed
EP-1102739-A1 GLUCOCORTICOID AND THYROID HORMONE RECEPTOR LIGANDS FOR THE TREATMENT OF METABOLIC DISORDERS KARO BIO AB (SE) 2001-05-30 EP disclosed
WO-2000007972-A1 GLUCOCORTICOID AND THYROID HORMONE RECEPTOR LIGANDS FOR THE TREATMENT OF METABOLIC DISORDERS KARO BIO AB (SE) 2000-02-17 WO disclosed