SCHEMBL4926016

SCHEMBL4926016

O=C(O)C(Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1I)NCl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PCNA P12004 14/20 0.52
LIG1 P18858 1/20 0.43
THRB P10828 5/20 0.40
THRA P10827 4/20 0.40
LMNA P02545 2/20 0.40
CYP2D6 P10635 1/20 0.40
TSHR P16473 1/20 0.40
MEN1 O00255 1/20 0.40
GABRP O00591 1/20 0.40
GABRD O14764 1/20 0.40
ABCB11 O95342 1/20 0.40
F2 P00734 1/20 0.40
GABRA1 P14867 1/20 0.40
GABRB1 P18505 1/20 0.40
GABRG2 P18507 1/20 0.40
GABRB3 P28472 1/20 0.40
ADORA1 P30542 1/20 0.40
GABRA5 P31644 1/20 0.40
GABRA3 P34903 1/20 0.40
PPARG P37231 1/20 0.40

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
SCHEMBL1115191 0.91 PCNA (0.52) PCNALIG1THRBTHRALMNA
SCHEMBL8988780 0.85 PCNA (0.47) PCNALIG1THRBTHRALMNA
SCHEMBL11226810 0.85 PCNA (0.47) PCNALIG1THRBTHRALMNA
SCHEMBL31368013 0.83 PCNA (0.71) PCNALIG1THRBTHRALMNA
SCHEMBL34943 0.83 PCNA (0.71) PCNALIG1THRBTHRALMNA
SCHEMBL2679290 0.82 PCNA (0.70) PCNALIG1THRBTHRALMNA
SCHEMBL5501440 0.82 PCNA (0.70) PCNALIG1THRBTHRALMNA
SCHEMBL9222347 0.81 PCNA (0.44) PCNALMNACYP2D6TSHR
Sulfuric Acid SCHEMBL2513306 0.80 PCNA (0.67) PCNALIG1THRBTHRALMNA
SCHEMBL9486078 0.76 PCNA (0.41) PCNALIG1TSHRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080003284-A1 LEVOTHYROXINE COMPOSITIONS AND METHOS FRANZ G A 2008-01-03 US disclosed
US-7101569-B2 Methods of administering levothyroxine pharmaceutical compositions KING PHARMACEUTICALS RESEARCH AND DEVELOPMENT, INC. 2006-09-05 US disclosed
EP-1474103-A1 LEVOTHYROXINE COMPOSITIONS AND METHODS King Pharmaceuticals, Inc. (US) 2004-11-10 EP disclosed
WO-2004014318-A2 LEVOTHYROXINE COMPOSITIONS AND METHODS KING PHARMACEUTICALS, INC. (US) 2004-02-19 WO disclosed
WO-2003070217-A1 LEVOTHYROXINE COMPOSITIONS AND METHODS KING PHARMACEUTICALS, INC. (US) 2003-08-28 WO disclosed
WO-2003061557-A2 LEVOTHYROXINE PHARMACEUTICAL COMPOSITIONS, METHODS OF MAKING AND METHODS OF ADMINISTRATION KING PHARMACEUTICALS, INC. (US) 2003-07-31 WO disclosed
US-6555581-B1 .00005-5 wt% of a levothyroxine salt, >/= 50 wt% of flat needle shape microcrystalline cellulose with bulk density of .10-.23 g/cm3 and conductivity of < 200 mu s/cm and .5-30 wt% disintegrating agent; immediate release for treating thyroids JONES PHARMA, INC. 2003-04-29 US disclosed
WO-2003028624-A2 LEVOTHYROXINE COMPOSITIONS AND METHODS KING PHARMACEUTICALS, INC (US) 2003-04-10 WO disclosed
WO-2003013441-A2 LEVOTHYROXINE COMPOSITIONS AND METHODS KING PHARMACEUTICALS, INC. (US) 2003-02-20 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-20080003284-A1 LEVOTHYROXINE COMPOSITIONS AND METHOS TPO, TRHDE, THRA PCNA 4874/4885LIG1 3330/4885THRB 7/4885

“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.