SCHEMBL6704911

SCHEMBL6704911

CCc1cccc(-c2cc(Oc3c(Cl)c(F)nc(OCC(=O)OC)c3Cl)ccc2OC)c1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 2/20 0.43
▸ THRB P10828 2/20 0.43
▸ FFAR1 O14842 13/20 0.38
▸ PPARD Q03181 7/20 0.38
▸ PDE4D Q08499 1/20 0.35
▸ CTSA P10619 2/20 0.35
▸ PLG P00747 1/20 0.35
▸ PLAU P00749 1/20 0.35
▸ HDAC4 P56524 1/20 0.35
▸ HDAC2 Q92769 1/20 0.35
▸ HDAC8 Q9BY41 1/20 0.35

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
SCHEMBL6695591 0.91 PDE4D (0.42) THRATHRBPDE4DCTSAHDAC4
SCHEMBL6690029 0.86 THRB (0.43) THRATHRBFFAR1PPARDPDE4D
SCHEMBL6692400 0.82 THRB (0.64) THRATHRBFFAR1PPARDPLAU
SCHEMBL6697148 0.81 MAPK1 (0.37) THRBHDAC4HDAC2HDAC8
SCHEMBL6692303 0.78 RORC (0.48) THRATHRB
SCHEMBL6693972 0.72 THRA (0.50) THRATHRB
SCHEMBL6695033 0.72 THRB (0.59) THRATHRB
SCHEMBL6700899 0.70 THRB (0.50) THRATHRBFFAR1PPARDPLAU
SCHEMBL6694659 0.70 RORC (0.49) THRATHRB
SCHEMBL6690833 0.69 THRB (0.57) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6747048-B2 TREATING DISEASES OR DISORDERS ASSOCIATED WITH METABOLISM DYSFUNCTION OR WHICH ARE DEPENDENT UPON THE EXPRESSION OF A T3 REGULATED GENE, BRISTOL-MYERS SQUIBB COMPANY 2004-06-08 — — US disclosed
US-20040039028-A1 Pyridine-based thyroid receptor ligands BRISTOL-MYERS SQUIBB COMPANY 2004-02-26 — — US disclosed
WO-2003094845-A2 PYRIDINE-BASED THYROID RECEPTOR LIGANDS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-11-20 — — 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-20040039028-A1 Pyridine-based thyroid receptor ligands TSHR, THRB, THRA THRA 3/4885THRB 2/4885FFAR1 116/4885

“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.

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