SCHEMBL29527366

SCHEMBL29527366

COc1ncc(Cc2c(C)cc(-n3nc(C#N)c(=O)[nH]c3=O)cc2C)cc1C(C)C

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 19/20 0.50
▸ THRA P10827 18/20 0.50
▸ CYP2C8 P10632 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ PDE10A Q9Y233 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
SCHEMBL29066246 1.00 THRB (0.50) THRBTHRACYP2C8CYP2C9PDE10A
SCHEMBL24449955 0.90 THRA (0.63) THRBTHRACYP2C8CYP2C9
SCHEMBL29527083 0.83 THRB (0.51) THRBTHRACYP2C8CYP2C9
SCHEMBL24449962 0.83 THRB (0.51) THRBTHRACYP2C8CYP2C9
SCHEMBL24449956 0.78 THRA (0.65) THRBTHRACYP2C8CYP2C9
SCHEMBL24450039 0.77 THRB (0.50) THRBTHRACYP2C8CYP2C9
SCHEMBL29066175 0.77 THRA (0.64) THRBTHRACYP2C8CYP2C9
SCHEMBL29527177 0.77 THRA (0.64) THRBTHRACYP2C8CYP2C9
SCHEMBL22632490 0.76 THRB (0.49) THRBTHRACYP2C8CYP2C9
SCHEMBL22633202 0.76 THRA (0.49) THRBTHRACYP2C8CYP2C9

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
EP-4240730-A1 2-PYRIDONES AS THYROID HORMONE RECEPTOR MODULATORS Aligos Therapeutics, Inc. (US) 2023-09-13 — — EP disclosed
CN-116710443-A 2-pyridones as thyroid hormone receptor modulators 阿利戈斯治疗公司 2023-09-05 — — CN disclosed
WO-2022099044-A1 2-PYRIDONES AS THYROID HORMONE RECEPTOR MODULATORS ALIGOS THERAPEUTICS, INC. (US) 2022-05-12 — — WO disclosed
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