SCHEMBL5116865

SCHEMBL5116865

CCS(=O)(=O)Nc1cc(C)cc(COc2c(Cl)cc(CCC(=O)O)cc2Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRA P10827 12/20 0.47
THRB P10828 12/20 0.47
FFAR4 Q5NUL3 5/20 0.44
FFAR1 O14842 3/20 0.44
ACLY P53396 1/20 0.42
AR P10275 2/20 0.38
ESR1 P03372 1/20 0.38
NR3C1 P04150 1/20 0.38
PGR P06401 1/20 0.38
NR3C2 P08235 1/20 0.38
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL5104431 0.90 THRA (0.47) THRATHRBFFAR4FFAR1ACLY
SCHEMBL5107952 0.90 THRA (0.46) THRATHRBFFAR4FFAR1ACLY
SCHEMBL4537137 0.89 THRB (0.61) THRATHRBFFAR4FFAR1AR
SCHEMBL4534757 0.89 THRB (0.41) THRATHRBACLYAR
SCHEMBL4351925 0.85 THRA (0.58) THRATHRBFFAR4FFAR1AR
SCHEMBL4929660 0.85 THRA (0.51) THRATHRBFFAR4FFAR1AR
SCHEMBL4362330 0.84 THRA (0.48) THRATHRBFFAR4FFAR1AR
SCHEMBL5106635 0.84 THRA (0.38) THRATHRBARALDH1A1
SCHEMBL4345800 0.84 THRA (0.46) THRATHRBFFAR4FFAR1AR
SCHEMBL5120011 0.83 THRA (0.47) THRATHRBFFAR4FFAR1AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080004251-A1 Novel Pharmaceutical Compositions Comprising Agonists of the Thyroid Receptor KARO BIO AB (SE) 2008-01-03 US 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-20080004251-A1 Novel Pharmaceutical Compositions Comprising Agonists of the Thyroid Receptor TSHR, TRHR, THRA THRA 3/4885THRB 4/4885FFAR4 60/4885

“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.