SCHEMBL4931389

SCHEMBL4931389

CCCNc1cc(Cl)cc(COc2c(Br)cc(CC(=O)O)cc2Br)c1F

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRB P10828 17/20 0.49
THRA P10827 16/20 0.49
S1PR2 O95136 1/20 0.36
S1PR1 P21453 1/20 0.36
S1PR3 Q99500 1/20 0.36
LPAR2 Q9HBW0 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
ALOX12 P18054 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
PPARG P37231 1/20 0.35

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
SCHEMBL4933925 0.91 THRB (0.39) THRBTHRAS1PR2S1PR1S1PR3
SCHEMBL4932596 0.90 THRB (0.51) THRBTHRA
SCHEMBL4931497 0.90 THRB (0.49) THRBTHRAPPARG
SCHEMBL4927401 0.87 THRB (0.50) THRBTHRAPPARG
SCHEMBL5117297 0.85 THRB (0.50) THRBTHRAKDM4EALDH1A1KMT2A
SCHEMBL4933354 0.85 THRB (0.49) THRBTHRAKDM4EALDH1A1LMNA
SCHEMBL5104946 0.85 THRB (0.48) THRBTHRAPPARG
SCHEMBL4930040 0.84 THRB (0.48) THRBTHRAPPARG
SCHEMBL4927472 0.84 SMN1; SMN2 (0.36) THRBTHRAALDH1A1LMNAKMT2A
SCHEMBL4932217 0.84 THRB (0.48) THRBTHRA

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 1 patent. 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

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 3/4885S1PR2 231/4885

“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.