SCHEMBL4353104

SCHEMBL4353104

CCC(C)Nc1cc(Cl)cc(COc2c(Br)cc(CCC(=O)O)cc2Br)c1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRB P10828 19/20 0.57
THRA P10827 18/20 0.57
ESR1 P03372 1/20 0.50
NR3C1 P04150 1/20 0.50
PGR P06401 1/20 0.50
NR3C2 P08235 1/20 0.50
AR P10275 1/20 0.50
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MCL1 Q07820 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
SCHEMBL4923405 0.90 THRA (0.45) THRBTHRAESR1NR3C1PGR
SCHEMBL4351492 0.90 THRB (0.61) THRBTHRAESR1NR3C1PGR
SCHEMBL4532509 0.89 THRA (0.60) THRBTHRAESR1NR3C1PGR
SCHEMBL4932642 0.89 THRB (0.53) THRBTHRA
SCHEMBL4932622 0.88 THRA (0.56) THRBTHRAESR1NR3C1PGR
SCHEMBL4352275 0.88 THRB (0.58) THRBTHRAESR1NR3C1PGR
SCHEMBL4354606 0.86 THRA (0.74) THRBTHRAESR1NR3C1PGR
SCHEMBL4935277 0.86 THRA (0.53) THRBTHRAESR1NR3C1PGR
SCHEMBL4934638 0.86 THRA (0.60) THRBTHRAESR1NR3C1PGR
SCHEMBL4362409 0.84 THRB (0.74) THRBTHRAESR1NR3C1PGR

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
WO-2009080835-A1 THYROMIMETRIC COMPOUNDS IN TREATMENT OF DISEASE RELATED TO SONIC HEDGEHOG SIGNALLING KARO BIO AB (SE) 2009-07-02 WO claimed
WO-2009080835-A1 THYROMIMETRIC COMPOUNDS IN TREATMENT OF DISEASE RELATED TO SONIC HEDGEHOG SIGNALLING KARO BIO AB (SE) 2009-07-02 WO disclosed
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 THRB 4/4885THRA 3/4885ESR1 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.