SCHEMBL9748136

SCHEMBL9748136

O=C(O)c1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 11/20 0.67
THRA P10827 9/20 0.67
PCNA P12004 8/20 0.67
LMNA P02545 4/20 0.67
POLB P06746 3/20 0.67
HIF1A Q16665 3/20 0.67
ABCB11 O95342 2/20 0.67
GABRA1 P14867 2/20 0.67
PPARG P37231 2/20 0.67
GABRA2 P47869 2/20 0.67
GABRB2 P47870 2/20 0.67
HPGD P15428 2/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
HSD17B10 Q99714 2/20 0.67
CYP1A2 P05177 1/20 0.67
PGR P06401 1/20 0.67
CHRM2 P08172 1/20 0.67
HTR1A P08908 1/20 0.67
ADRA2A P08913 1/20 0.67
ADORA3 P0DMS8 1/20 0.67

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
SCHEMBL4008454 0.83 PCNA (0.61) THRBTHRAPCNALMNAPOLB
SCHEMBL24407712 0.83 THRB (0.54) THRBTHRAPCNALMNAPOLB
SCHEMBL7526093 0.83 THRB (0.72) THRBTHRA
SCHEMBL9522943 0.81 THRB (0.64) THRBTHRAPCNALMNAPOLB
SCHEMBL6720943 0.81 TPMT (0.50) THRBTHRAPCNALMNAPOLB
Tiratricol SCHEMBL30161572 0.80 THRB (1.00) THRBTHRAPCNALMNAPOLB
Tiratricol SCHEMBL25149 0.80 THRB (1.00) THRBTHRAPCNALMNAPOLB
Tiratricol SCHEMBL743426 0.80 THRB (1.00) THRBTHRAPCNALMNAPOLB
SCHEMBL7086473 0.79 THRB (0.61) THRBTHRAPCNALMNAPOLB
Tiratricol SCHEMBL2671904 0.79 THRB (0.97) THRBTHRAPCNALMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9580395-B2 Compositions of dual thyrointegrin antagonists and use in vascular-associated disorders VASCULAR VISION PHARMACEUTICAL COMPANY (US) 2017-02-28 US disclosed
US-20150031688-A1 COMPOSITIONS OF DUAL THYROINTEGRIN ANTAGONISTS AND USE IN VASCULAR-ASSOCIATED DISORDERS NANOPHARMACEUTICALS, LLC 2015-01-29 US disclosed
US-8859539-B2 Compositions of dual thyrointegrin antagonists and use in vascular-associated disorders VASCULAR VISION PHARMACEUTICAL COMPANY (US) 2014-10-14 US disclosed
EP-0204523-B1 GLUCOSE-6-PHOSPHATE DEHYDROGENASE CONJUGATES, THEIR PREPARATION AND USE SYNTEX (U.S.A.) INC. (US) 1992-02-26 EP disclosed
US-4847195-A IMMUNOASSAY SYNTEX (U.S.A.) INC. (US) 1989-07-11 US disclosed
EP-0204523-A2 Glucose-6-phosphate dehydrogenase conjugates, their preparation and use SYNTEX (U.S.A.) INC. (US) 1986-12-10 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-20150031688-A1 COMPOSITIONS OF DUAL THYROINTEGRIN ANTAGONISTS AND USE IN VASCULAR-ASSOCIATED DISORDERS TEK, THRA, TSHR THRB 4/4885THRA 2/4885PCNA 3945/4885

“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.