SCHEMBL4353533

SCHEMBL4353533

CCCNc1cccc(COc2c(Br)cc(CCC(=O)O)cc2Br)c1

nearest known ligand 0.84

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRA P10827 14/20 0.84
THRB P10828 14/20 0.84
ESR1 P03372 1/20 0.66
NR3C1 P04150 1/20 0.66
PGR P06401 1/20 0.66
NR3C2 P08235 1/20 0.66
AR P10275 1/20 0.66
FFAR1 O14842 6/20 0.46
FFAR4 Q5NUL3 2/20 0.46

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
SCHEMBL4541153 0.94 THRA (0.80) THRATHRBESR1NR3C1PGR
SCHEMBL4932204 0.90 THRA (0.78) THRATHRBESR1NR3C1PGR
SCHEMBL4351564 0.89 THRA (0.67) THRATHRBESR1NR3C1PGR
SCHEMBL4923070 0.89 THRB (0.66) THRATHRBESR1NR3C1PGR
SCHEMBL4353468 0.89 THRA (0.76) THRATHRBESR1NR3C1PGR
SCHEMBL4536527 0.89 THRA (0.76) THRATHRBESR1NR3C1PGR
SCHEMBL4355776 0.86 THRA (0.79) THRATHRBESR1NR3C1PGR
SCHEMBL4358756 0.86 THRA (0.79) THRATHRBESR1NR3C1PGR
SCHEMBL4351420 0.86 THRA (0.75) THRATHRBESR1NR3C1PGR
SCHEMBL4349548 0.86 THRA (0.78) THRATHRBESR1NR3C1PGR

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
WO-2009080835-A1 THYROMIMETRIC COMPOUNDS IN TREATMENT OF DISEASE RELATED TO SONIC HEDGEHOG SIGNALLING KARO BIO AB (SE) 2009-07-02 WO claimed
US-20080221210-A1 Thyroid Receptor Agonists KARO BIO AB (SE) 2008-09-11 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-20080221210-A1 Thyroid Receptor Agonists TSHR, TRHR, THRA THRA 3/4885THRB 4/4885ESR1 246/4885

“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.