SCHEMBL21291186

SCHEMBL21291186

COc1cc(OCP(=O)(O)O)cc(OC)c1Cc1ccc(F)c(C(C)C)c1

nearest known ligand 0.78

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
THRB P10828 16/20 0.78
THRA P10827 15/20 0.78
PTPN1 P18031 1/20 0.38
ADRB2 P07550 1/20 0.34
ADRB3 P13945 1/20 0.34
CETP P11597 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
SCHEMBL328469 0.88 THRA (1.00) THRBTHRA
SCHEMBL282541 0.86 THRB (0.77) THRBTHRA
SCHEMBL328509 0.85 THRB (0.59) THRBTHRAPTPN1ADRB2ADRB3
SCHEMBL13044628 0.81 THRB (0.76) THRBTHRA
SCHEMBL13381655 0.79 THRB (0.65) THRBTHRA
SCHEMBL13381669 0.78 THRB (0.53) THRBTHRAADRB2ADRB3
SCHEMBL19982699 0.78 THRB (0.67) THRBTHRAPTPN1
SCHEMBL13381641 0.76 THRA (0.80) THRBTHRACETP
SCHEMBL21291168 0.75 THRA (0.78) THRBTHRA
SCHEMBL3160054 0.74 THRB (0.71) THRBTHRA

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 THRB 4/4885THRA 3/4885PTPN1 142/4885

“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.