SCHEMBL4518871

SCHEMBL4518871

Cc1c(-c2ccncc2)[nH]c2ccc(Oc3c(Br)cc(CCC(=O)O)cc3Br)cc12

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRA P10827 12/20 0.48
THRB P10828 12/20 0.48
TBXAS1 P24557 1/20 0.44
F2 P00734 2/20 0.42
F10 P00742 2/20 0.42
PCNA P12004 2/20 0.39
POLB P06746 1/20 0.39
MAPK1 P28482 1/20 0.39
HIF1A Q16665 1/20 0.39
PPARG P37231 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ALOX5 P09917 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
SCHEMBL4528982 0.90 THRA (0.49) THRATHRBF2F10PPARG
SCHEMBL4522420 0.84 THRB (0.55) THRATHRBTBXAS1F2F10
SCHEMBL3990206 0.82 THRA (0.48) THRATHRBF2F10PPARG
SCHEMBL11070611 0.81 TBXAS1 (0.63) TBXAS1F2PPARG
Hydrochloric Acid SCHEMBL11005148 0.81 TBXAS1 (0.61) TBXAS1F2PPARG
SCHEMBL4513504 0.79 PPARG (0.49) THRATHRBF2F10PPARG
SCHEMBL4532920 0.78 THRA (0.49) THRATHRBPPARGKDM4EALDH1A1
SCHEMBL3993120 0.78 THRA (0.38) THRATHRBPPARG
SCHEMBL4351916 0.78 PPARG (0.51) THRATHRBF2F10PPARG
SCHEMBL4349830 0.78 THRA (0.47) THRATHRBF2F10PPARG

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-20090233979-A1 Indole Derivatives and Their Use as Thyroid Receptor Ligands KARO BIO AB (SE) 2009-09-17 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-20090233979-A1 Indole Derivatives and Their Use as Thyroid Receptor Ligands TSHR, TRHR, THRA THRA 3/4885THRB 4/4885TBXAS1 921/4885

“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.