SCHEMBL4934307

SCHEMBL4934307

CNc1cc(C)cc(COc2c(Cl)cc(NC(=O)CC(=O)O)cc2Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
THRA P10827 6/20 0.37
THRB P10828 6/20 0.37
KMT2A Q03164 3/20 0.37
POLB P06746 2/20 0.36
HDAC8 Q9BY41 1/20 0.36
MEN1 O00255 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPT P10636 1/20 0.35
MRGPRX4 Q96LA9 2/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL5110746 0.91 RORC (0.40) CYP1A2CYP3A4THRATHRBKMT2A
SCHEMBL5108656 0.91 ALDH1A1 (0.46) CYP1A2CYP3A4THRATHRBKMT2A
SCHEMBL4930955 0.89 L3MBTL1 (0.40) THRATHRBKMT2AMEN1ALDH1A1
SCHEMBL4931728 0.88 THRA (0.42) CYP1A2CYP3A4THRATHRBKMT2A
SCHEMBL4934206 0.88 THRB (0.45) CYP1A2CYP3A4THRATHRBKMT2A
SCHEMBL4931960 0.88 ALDH1A1 (0.45) CYP1A2CYP3A4THRATHRBKMT2A
SCHEMBL4931980 0.87 THRB (0.38) CYP1A2CYP3A4THRATHRBKMT2A
SCHEMBL5119273 0.87 KMT2A (0.40) CYP1A2CYP3A4THRATHRBKMT2A
SCHEMBL5717877 0.87 THRA (0.36) THRATHRBKMT2AMEN1ALDH1A1
SCHEMBL5119963 0.86 GRIN1 (0.41) CYP1A2CYP3A4THRATHRBKMT2A

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 CYP1A2 1307/4885CYP3A4 2057/4885THRA 3/4885

“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.