SCHEMBL6695481

SCHEMBL6695481

CS(=O)(=O)c1cc(Oc2c(Cl)c(F)nc(NCC(=O)O)c2Cl)ccc1O

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 10/20 0.37
▸ THRB P10828 10/20 0.37
▸ PIN1 Q13526 1/20 0.34
▸ HIF1A Q16665 1/20 0.33
▸ PCNA P12004 1/20 0.33

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
SCHEMBL7258380 0.91 THRA (0.39) THRATHRBPIN1HIF1A
SCHEMBL6697155 0.87 L3MBTL1 (0.39) THRATHRBHIF1A
SCHEMBL6694254 0.87 CA12 (0.34) THRATHRBPIN1
SCHEMBL6692436 0.86 ATM (0.39) THRATHRB
SCHEMBL6699450 0.85 THRB (0.39) THRATHRBPIN1
SCHEMBL6693202 0.84 THRA (0.54) THRATHRB
Methane SCHEMBL6690821 0.83 THRA (0.53) THRATHRB
SCHEMBL6692015 0.81 THRB (0.47) THRATHRBPIN1
SCHEMBL6695738 0.81 THRB (0.53) THRATHRB
SCHEMBL6695033 0.79 THRB (0.59) 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-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

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 2/4885PIN1 3932/4885

“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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