SCHEMBL4932730

SCHEMBL4932730

CNc1cccc(COc2c(Br)cc(CC(=O)O)cc2Br)c1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
THRB P10828 19/20 0.61
THRA P10827 18/20 0.61
ESR1 P03372 1/20 0.54
NR3C1 P04150 1/20 0.54
PGR P06401 1/20 0.54
NR3C2 P08235 1/20 0.54
AR P10275 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL4355776 0.88 THRA (0.79) THRBTHRAESR1NR3C1PGR
SCHEMBL5119092 0.88 THRB (0.59) THRBTHRAESR1NR3C1PGR
SCHEMBL4360489 0.88 THRB (0.79) THRBTHRAESR1NR3C1PGR
SCHEMBL4929427 0.88 THRA (0.47) THRBTHRA
SCHEMBL4929753 0.87 THRB (0.58) THRBTHRAESR1NR3C1PGR
SCHEMBL5110363 0.86 THRB (0.60) THRBTHRAESR1NR3C1PGR
SCHEMBL4923070 0.86 THRB (0.66) THRBTHRAESR1NR3C1PGR
SCHEMBL5119841 0.85 THRB (0.56) THRBTHRAESR1NR3C1PGR
SCHEMBL4931778 0.84 THRB (0.56) THRBTHRAESR1NR3C1PGR
SCHEMBL4933926 0.84 THRB (0.56) THRBTHRAESR1NR3C1PGR

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-20080221210-A1 Thyroid Receptor Agonists KARO BIO AB (SE) 2008-09-11 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-20080221210-A1 Thyroid Receptor Agonists TSHR, TRHR, THRA THRB 4/4885THRA 3/4885ESR1 246/4885

“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.