SCHEMBL21291190

SCHEMBL21291190

CC(C)c1cc(Oc2c(Cl)cc(OCP(=O)(OCOC(=O)C(C)(C)C)OCOC(=O)C(C)(C)C)cc2Cl)ccc1O

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 15/20 0.53
▸ THRB P10828 15/20 0.53

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
SCHEMBL13044652 0.89 THRB (0.66) THRATHRB
SCHEMBL13946979 0.86 THRB (0.59) THRATHRB
SCHEMBL13044716 0.84 THRA (0.59) THRATHRB
SCHEMBL21291333 0.83 THRB (0.58) THRATHRB
SCHEMBL21291353 0.83 THRA (0.55) THRATHRB
SCHEMBL13381930 0.83 THRA (0.64) THRATHRB
SCHEMBL10274239 0.80 THRA (0.77) THRATHRB
SCHEMBL3147833 0.79 THRA (0.66) THRATHRB
SCHEMBL13381617 0.79 THRA (0.68) THRATHRB
SCHEMBL13381849 0.78 THRA (0.52) THRATHRB

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-20190255080-A1 METHOD OF REDUCING THYROID-ASSOCIATED SIDE EFFECTS CITIBANK, N.A., AS ADMINISTRATIVE AGENT 2019-08-22 — — 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-20190255080-A1 METHOD OF REDUCING THYROID-ASSOCIATED SIDE EFFECTS TSHR, TPO, THRA THRA 3/4885THRB 4/4885

“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.

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