SCHEMBL5402774

SCHEMBL5402774

CC(C)c1cc(Oc2c(C(F)(F)F)cc(N)c3c2CCC3)ccc1OCc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.37
THRB P10828 11/20 0.35
THRA P10827 9/20 0.35
RORC P51449 2/20 0.35
GLRA1 P23415 2/20 0.33
PPARG P37231 1/20 0.33
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33
MRGPRX4 Q96LA9 1/20 0.33
PTGER1 P34995 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
SCHEMBL5404292 0.88 THRB (0.43) THRBTHRARORCGLRA1
SCHEMBL5404873 0.86 POLB (0.38) ARTHRBTHRARORC
SCHEMBL5397848 0.86 THRB (0.45) THRBTHRARORC
SCHEMBL5407893 0.80 THRB (0.47) THRBTHRARORC
SCHEMBL5397627 0.78 THRB (0.43) THRBTHRARORCGLRA1
SCHEMBL5401387 0.78 THRB (0.50) THRBTHRA
SCHEMBL5393741 0.76 MAOB (0.43) THRBTHRA
SCHEMBL5399732 0.76 THRB (0.54) THRBTHRARORCGLRA1
SCHEMBL5396862 0.76 THRB (0.44) THRBTHRARORCGLRA1
SCHEMBL6624072 0.76 THRB (0.44) THRBTHRARORCGLRA1

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
US-7230031-B2 Thyroid hormone receptor ligand, medicinal compositions containing the same and use thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2007-06-12 US disclosed
US-20050085541-A1 Novel thyroid hormone receptor ligand, medicinal compositions containing the same and use thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2005-04-21 US disclosed
EP-1471049-A1 NOVEL THYROID HORMONE RECEPTOR LIGAND, MEDICINAL COMPOSITIONS CONTAINING THE SAME AND USE THEREOF Kissei Pharmaceutical Co., Ltd. (JP) 2004-10-27 EP 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-20050085541-A1 Novel thyroid hormone receptor ligand, medicinal compositions containing the same and use thereof TSHR, THRA, THRB AR 130/4885THRB 3/4885THRA 2/4885

“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.