SCHEMBL10105511

SCHEMBL10105511

Cc1ccc(Cc2c(C)cc(S(=O)(=O)O)cc2C)cc1C(C)C

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 16/20 0.48
THRA P10827 15/20 0.48
HTT P42858 1/20 0.39
POLB P06746 1/20 0.36
RECQL P46063 1/20 0.36
ESR2 Q92731 1/20 0.36
FABP3 P05413 1/20 0.35
FABP4 P15090 1/20 0.35
FABP5 Q01469 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
SCHEMBL666284 0.89 THRB (0.62) THRBTHRAHTTESR2
SCHEMBL667473 0.85 THRB (0.45) THRBTHRAHTT
SCHEMBL25983465 0.80 THRB (0.53) THRBTHRAESR2
SCHEMBL10105507 0.77 THRB (0.47) THRBTHRAESR2
SCHEMBL17417188 0.76 HTT (0.54) HTTFABP3FABP4FABP5
SCHEMBL10105497 0.76 THRB (0.49) THRBTHRAESR2
SCHEMBL10105496 0.75 THRB (0.50) THRBTHRAHTT
SCHEMBL10105493 0.75 THRB (0.50) THRBTHRA
SCHEMBL664208 0.74 THRB (0.64) THRBTHRAESR2
SCHEMBL18028280 0.73 THRB (0.82) 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-20120046364-A1 Novel Sulfonic Acid-Containing Thyromimetics, and Methods for Their Use METABASIS THERAPEUTICS, INC. (US) 2012-02-23 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-20120046364-A1 Novel Sulfonic Acid-Containing Thyromimetics, and Methods for Their Use THRB, TSHR, THRA THRB 1/4885THRA 3/4885HTT 2845/4885

“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.