SCHEMBL5964531

SCHEMBL5964531

CC(C(=O)O)c1cc(Br)c(Oc2cc(Br)c(O)c(Br)c2)c(Br)c1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRA P10827 11/20 0.52
THRB P10828 11/20 0.52
PPARG P37231 2/20 0.42
PTGS1 P23219 3/20 0.41
PTGS2 P35354 3/20 0.41
AKR1C3 P42330 2/20 0.41
AKR1C2 P52895 2/20 0.41
CDC42 P60953 1/20 0.41
RAC1 P63000 1/20 0.41
CYP1A2 P05177 1/20 0.41
TSHR P16473 1/20 0.41
SLC22A6 Q4U2R8 1/20 0.41
FOLH1 Q04609 1/20 0.39

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
SCHEMBL5964865 0.85 TTR (0.48) PTGS1PTGS2AKR1C3AKR1C2CDC42
SCHEMBL5964846 0.84 THRA (0.48) THRATHRBPTGS1PTGS2AKR1C3
SCHEMBL5858288 0.84 PTGS2 (0.54) THRATHRBPTGS1PTGS2AKR1C3
SCHEMBL5964537 0.83 THRA (0.62) THRATHRB
SCHEMBL5964844 0.81 THRA (0.58) THRATHRB
SCHEMBL5964560 0.81 THRA (0.44) THRATHRBPPARGPTGS1
SCHEMBL5964592 0.79 THRA (0.53) THRATHRB
SCHEMBL5964843 0.78 THRA (0.73) THRATHRB
SCHEMBL5861511 0.78 THRB (0.52) THRATHRBPPARGCYP1A2TSHR
SCHEMBL5964528 0.78 THRA (0.49) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7153997-B2 Benzamide derivatives as thyroid receptor ligands KARO BIO AB (SE) 2006-12-26 US disclosed
US-20060135614-A1 Novel compounds NORIN, THOMAS ANDERS WILSON (SE) 2006-06-22 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-20060135614-A1 Novel compounds THRB, TSHR, THRA THRA 3/4885THRB 1/4885PPARG 14/4885

“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.