SCHEMBL29414782

SCHEMBL29414782

Nc1nn(-c2cc(Cl)c(Oc3cc(C4CCOCC4)c(Cl)nn3)c(Cl)c2)c(=O)[nH]c1=O

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 18/20 0.51
▸ THRA P10827 12/20 0.51
▸ CYP2C9 P11712 2/20 0.51
▸ UGT1A1 P22309 1/20 0.51
▸ ABCG2 Q9UNQ0 1/20 0.51
▸ SLCO1B1 Q9Y6L6 1/20 0.51
▸ CYP2C8 P10632 1/20 0.37

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
SCHEMBL22632608 1.00 THRB (0.51) THRBTHRACYP2C9UGT1A1ABCG2
SCHEMBL29414741 0.95 THRB (0.49) THRBTHRACYP2C9UGT1A1ABCG2
SCHEMBL22633130 0.95 THRB (0.49) THRBTHRACYP2C9UGT1A1ABCG2
SCHEMBL28708390 0.91 THRB (0.49) THRBTHRACYP2C9UGT1A1ABCG2
SCHEMBL22632571 0.87 THRB (0.62) THRBTHRACYP2C9UGT1A1ABCG2
SCHEMBL22632900 0.86 THRB (0.48) THRBTHRACYP2C9UGT1A1ABCG2
SCHEMBL29414863 0.86 THRB (0.48) THRBTHRACYP2C9UGT1A1ABCG2
SCHEMBL38660927 0.84 THRB (0.49) THRBTHRACYP2C9UGT1A1ABCG2
SCHEMBL22643873 0.82 THRB (0.61) THRBTHRACYP2C9UGT1A1ABCG2
SCHEMBL22633093 0.80 THRB (0.47) THRBTHRACYP2C9UGT1A1ABCG2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122036699-A THR-beta modulators and methods of use thereof 阿利戈斯治疗公司 2026-05-15 — — CN disclosed
EP-3965884-A1 MODULATORS OF THR-BETA AND METHODS OF USE THEREOF Aligos Therapeutics, Inc. (US) 2022-03-16 — — EP disclosed
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