SCHEMBL4922892

SCHEMBL4922892

N#Cc1cc(COc2c(Br)cc(CC(=O)O)cc2Br)cc(NC2CCC2)c1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRB P10828 14/20 0.50
THRA P10827 13/20 0.50
DHODH Q02127 1/20 0.35
PTPN1 P18031 3/20 0.35
ESR1 P03372 1/20 0.34
NR3C1 P04150 1/20 0.34
PGR P06401 1/20 0.34
NR3C2 P08235 1/20 0.34
AR P10275 1/20 0.34
MRGPRX4 Q96LA9 1/20 0.34
PTGDR2 Q9Y5Y4 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
SCHEMBL4929691 0.90 THRA (0.52) THRBTHRADHODHESR1NR3C1
SCHEMBL4934191 0.85 EGLN1 (0.36) THRBTHRADHODHPTPN1MRGPRX4
SCHEMBL5718319 0.85 THRB (0.51) THRBTHRADHODHPTPN1ESR1
SCHEMBL4932002 0.84 THRB (0.50) THRBTHRADHODHPTPN1ESR1
SCHEMBL4932765 0.84 THRB (0.50) THRBTHRADHODHPTPN1
SCHEMBL4931340 0.83 THRB (0.51) THRBTHRAESR1NR3C1PGR
SCHEMBL4927550 0.82 THRB (0.53) THRBTHRADHODHPTPN1ESR1
SCHEMBL4932606 0.82 THRB (0.49) THRBTHRAESR1NR3C1PGR
SCHEMBL5717898 0.82 MRGPRX4 (0.35) THRBTHRAMRGPRX4PTGDR2
SCHEMBL4934533 0.82 THRB (0.47) THRBTHRAPTPN1MRGPRX4

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-20080221210-A1 Thyroid Receptor Agonists KARO BIO AB (SE) 2008-09-11 US disclosed
EP-1732533-A1 THYROID RECEPTOR AGONISTS KARO BIO AB (SE) 2006-12-20 EP disclosed
WO-2005092317-A1 THYROID RECEPTOR AGONISTS 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-20080221210-A1 Thyroid Receptor Agonists TSHR, TRHR, THRA THRB 4/4885THRA 3/4885DHODH 4020/4885

“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.