SCHEMBL4818644

SCHEMBL4818644

CCN(CC)CC.NC(Cc1cc(Br)c(OCc2cccc(OC(F)F)c2)c(Br)c1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRA P10827 9/20 0.48
THRB P10828 9/20 0.48
PPARG P37231 1/20 0.43
MRGPRX4 Q96LA9 1/20 0.42
SLC1A5 Q15758 1/20 0.42
ESR1 P03372 1/20 0.41
NR3C1 P04150 1/20 0.41
PGR P06401 1/20 0.41
NR3C2 P08235 1/20 0.41
AR P10275 1/20 0.41
MEP1B Q16820 1/20 0.41
PDCD1 Q15116 1/20 0.40
CD274 Q9NZQ7 1/20 0.40
ALKBH1 Q13686 1/20 0.39
PTGER1 P34995 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
SCHEMBL4808246 0.91 THRA (0.46) THRATHRBPPARGMRGPRX4SLC1A5
SCHEMBL4810919 0.87 THRA (0.50) THRATHRBPPARGESR1NR3C1
SCHEMBL4818118 0.87 THRB (0.50) THRATHRBPPARGNR3C1PGR
SCHEMBL4808835 0.86 THRA (0.56) THRATHRBPPARGSLC1A5ESR1
SCHEMBL4809817 0.81 THRB (0.46) THRATHRBPPARGNR3C1PGR
SCHEMBL4809557 0.80 THRA (0.45) THRATHRBPPARGPDCD1CD274
SCHEMBL4816034 0.79 THRB (0.47) THRATHRBPPARGNR3C1PGR
SCHEMBL4812326 0.79 THRA (0.64) THRATHRBPPARGESR1NR3C1
SCHEMBL4899376 0.79 THRA (0.64) THRATHRBPPARGESR1NR3C1
SCHEMBL4815513 0.78 SLC1A5 (0.49) THRATHRBPPARGSLC1A5PDCD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7319096-B2 Thyroid hormone receptor antagonists for cardiac and metabolic disorders II KARO BIO AB (SE) 2008-01-15 US claimed
US-20040220147-A1 Thyroid hormone receptor antagonists for cardiac and metabolic disorders ll KARO BIO AB (SE) 2004-11-04 US claimed
US-7319096-B2 Thyroid hormone receptor antagonists for cardiac and metabolic disorders II KARO BIO AB (SE) 2008-01-15 US disclosed
US-20040220147-A1 Thyroid hormone receptor antagonists for cardiac and metabolic disorders ll KARO BIO AB (SE) 2004-11-04 US disclosed
EP-1387825-A1 THYROID HORMONE RECEPTOR ANTAGONISTS FOR CARDIAC & METABOLIC DISORDERS II KARO BIO AB (SE) 2004-02-11 EP disclosed
WO-2002092550-A1 THYROID HORMONE RECEPTOR ANTAGONISTS FOR CARDIAC AND METABOLIC DISORDERS II KARO BIO AB (SE) 2002-11-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040220147-A1 Thyroid hormone receptor antagonists for cardiac and metabolic disorders ll TSHR, TRHR, THRA THRA 3/4885THRB 4/4885PPARG 36/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.