SCHEMBL5385245

SCHEMBL5385245

COC(=O)Cc1cc(Cl)c(Oc2ccc(NC(=O)C(C)C)c(Br)c2)c(Cl)c1

nearest known ligand 0.82

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 16/20 0.82
THRA P10827 12/20 0.82
RORC P51449 4/20 0.43
KDM4E B2RXH2 1/20 0.41
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
MTNR1B P49286 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
SCHEMBL5382651 0.91 THRB (0.78) THRBTHRARORCKDM4E
SCHEMBL5392866 0.90 THRA (1.00) THRBTHRA
SCHEMBL5396335 0.90 THRB (0.74) THRBTHRARORCKDM4ECA12
SCHEMBL5385620 0.90 THRB (0.67) THRBTHRARORC
SCHEMBL7204449 0.89 THRB (0.75) THRBTHRARORCKDM4ECA12
SCHEMBL5406458 0.88 THRB (0.65) THRBTHRARORCCA12CA1
SCHEMBL5406523 0.85 THRB (0.72) THRBTHRARORCCA12CA1
SCHEMBL5387224 0.85 THRB (0.81) THRBTHRARORC
SCHEMBL5391643 0.85 THRB (0.60) THRBTHRARORC
SCHEMBL5397843 0.84 THRB (0.60) THRBTHRARORCCA12CA1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7199265-B2 Thyroid receptor ligands, pharmaceutical compositions comprising them and their use in the treatment of disorders influenced by thyroid hormones KARO BIO AB (SE) 2007-04-03 US disclosed
US-20040097589-A1 Thyroid receptor ligands, pharmaceutical compositions comprising them and their use in the treatment of disorders influenced by thyroid hormones KARO BIO AB (SE) 2004-05-20 US disclosed
EP-1296936-A1 THYROID RECEPTOR LIGANDS, PHARMACEUTICAL COMPOSITIONS COMPRISING THEM AND THEIR USE IN THE TREATMENT OF DISORDERS INFLUENCED BY THYROID HORMONES KARO BIO AB (SE) 2003-04-02 EP disclosed
WO-2001098256-A1 THYROID RECEPTOR LIGANDS, PHARMACEUTICAL COMPOSITIONS COMPRISING THEM AND THEIR USE IN THE TREATMENT OF DISORDERS INFLUENCED BY THYROID HORMONES KARO BIO AB (SE) 2001-12-27 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-20040097589-A1 Thyroid receptor ligands, pharmaceutical compositions comprising them and their use in the treatment of disorders influenced by thyroid hormones TSHR, THRA, THRB THRB 3/4885THRA 2/4885RORC 220/4885

“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.