SCHEMBL31258407

SCHEMBL31258407

CC(C)(C)OC(=O)Nc1nn(-c2cc(Cl)c(Oc3ccc([N+](=O)[O-])c(Br)c3)c(Cl)c2)c(=O)[nH]c1=O

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 18/20 0.57
THRA P10827 8/20 0.57
CYP2C9 P11712 1/20 0.33
UGT1A1 P22309 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.33
SLCO1B1 Q9Y6L6 1/20 0.33
PKM P14618 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
SCHEMBL22632750 1.00 THRB (0.57) THRBTHRACYP2C9UGT1A1ABCG2
SCHEMBL29414838 0.89 THRB (0.42) THRBTHRA
SCHEMBL22632721 0.87 THRB (0.60) THRBTHRACYP2C9UGT1A1ABCG2
SCHEMBL23663170 0.85 THRB (0.65) THRBTHRACYP2C9UGT1A1ABCG2
SCHEMBL22632658 0.84 THRB (0.59) THRBTHRACYP2C9UGT1A1ABCG2
SCHEMBL22632655 0.84 THRB (0.59) THRBTHRACYP2C9UGT1A1ABCG2
SCHEMBL23663470 0.81 THRB (0.60) THRBTHRA
SCHEMBL29414683 0.81 THRA (0.51) THRBTHRA
SCHEMBL22632525 0.81 THRA (0.51) THRBTHRA
SCHEMBL31258413 0.79 THRA (0.41) THRBTHRAPKM

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-20250304561-A1 MODULATORS OF THR-BETA AND METHODS OF USE THEREOF ALIGOS THERAPEUTICS, INC. (US) 2025-10-02 US disclosed
EP-4523692-A2 MODULATORS OF THR-SS AND METHODS OF USE THEREOF Aligos Therapeutics, Inc. (US) 2025-03-19 EP disclosed
EP-3965884-B1 MODULATORS OF THR-BETA WITH A DIOXO-1,2,4-TRIAZYL HEAD GROUP ALIGOS THERAPEUTICS INC (US) 2025-01-15 EP 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-20250304561-A1 MODULATORS OF THR-BETA AND METHODS OF USE THEREOF THRB, THRA, TRHR THRB 1/4885THRA 2/4885CYP2C9 3117/4885

“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.