SCHEMBL3141371

SCHEMBL3141371

CCc1cc(C)c2cc(Oc3c(Br)cc(C(=O)NCC(=O)O)cc3Br)cc(F)c2n1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 8/20 0.38
THRB P10828 11/20 0.37
THRA P10827 4/20 0.36
HIF1A Q16665 2/20 0.35
BBOX1 O75936 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A3 Q01959 1/20 0.34
ASPH Q12797 1/20 0.34
KDM8 Q8N371 1/20 0.34
FTO Q9C0B1 1/20 0.34
F2 P00734 1/20 0.34

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
SCHEMBL3133494 0.78 THRA (0.38) THRBTHRA
SCHEMBL3138206 0.77 THRB (0.42) EGLN1THRBTHRAHIF1ABBOX1
SCHEMBL3142284 0.77 THRB (0.34) THRBTHRA
SCHEMBL3140929 0.75 THRA (0.43) THRBTHRA
SCHEMBL3141209 0.73 THRB (0.46) EGLN1THRBTHRABBOX1SLC6A2
SCHEMBL3141250 0.71 THRA (0.37) THRBTHRA
Propionic Acid SCHEMBL5074391 0.71 THRA (0.35) THRBTHRA
SCHEMBL3137311 0.71 THRB (0.42) EGLN1THRBTHRABBOX1SLC6A2
SCHEMBL5077538 0.69 THRB (0.39) THRBTHRA
SCHEMBL3146227 0.67 PPARD (0.40)

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-20100004271-A1 HETEROCYCLIC COMPOUNDS AS AGANIST FOR THE THYROID RECEPTOR KARO BIO AB (SE) 2010-01-07 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-20100004271-A1 HETEROCYCLIC COMPOUNDS AS AGANIST FOR THE THYROID RECEPTOR TSHR, GHSR, TRHR EGLN1 1315/4885THRB 6/4885THRA 4/4885

“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.