SCHEMBL5116916

SCHEMBL5116916

CC(=O)Nc1cc(COc2c(Br)cc(CC(=O)O)cc2Br)cc(C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 15/20 0.50
THRA P10827 13/20 0.50
LMNA P02545 1/20 0.40
NR2E1 Q9Y466 1/20 0.39
PPARD Q03181 1/20 0.39
ALDH1A1 P00352 1/20 0.39
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38

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
SCHEMBL5105557 0.89 THRA (0.65) THRBTHRALMNA
SCHEMBL5115594 0.89 THRB (0.50) THRBTHRALMNAALDH1A1RXRA
SCHEMBL5108768 0.89 PPARD (0.46) THRBTHRALMNANR2E1PPARD
SCHEMBL4922875 0.89 THRB (0.52) THRBTHRAPPARDRXRARXRB
SCHEMBL5118031 0.88 THRB (0.47) THRBTHRALMNAALDH1A1
SCHEMBL5104439 0.88 THRA (0.47) THRBTHRALMNANR2E1ALDH1A1
SCHEMBL4930845 0.88 THRB (0.49) THRBTHRAPPARD
SCHEMBL4930674 0.87 THRB (0.53) THRBTHRAPPARDRXRARXRB
SCHEMBL4932092 0.86 THRB (0.51) THRBTHRARXRARXRBRXRG
SCHEMBL5112643 0.85 THRA (0.44) THRBTHRALMNANR2E1ALDH1A1

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-20080004251-A1 Novel Pharmaceutical Compositions Comprising Agonists of the Thyroid Receptor KARO BIO AB (SE) 2008-01-03 US disclosed
EP-1732532-A1 NOVEL PHARMACEUTICAL COMPOSITIONS COMPRISING AGONISTS OF THE THYROID RECEPTOR KARO BIO AB (SE) 2006-12-20 EP disclosed
WO-2005092316-A1 NOVEL PHARMACEUTICAL COMPOSITIONS COMPRISING AGONISTS OF THE THYROID RECEPTOR KARO BIO AB (SE) 2005-10-06 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-20080004251-A1 Novel Pharmaceutical Compositions Comprising Agonists of the Thyroid Receptor TSHR, TRHR, THRA THRB 4/4885THRA 3/4885LMNA 3643/4885

“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.