SCHEMBL29527109

SCHEMBL29527109

Cc1c(Oc2c(Cl)cc(N3C=NC=C(N)N3)cc2Cl)c[nH]c(=O)c1C(C)C

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 3/20 0.33
▸ THRB P10828 3/20 0.33
▸ CYP2C9 P11712 2/20 0.33
▸ UGT1A1 P22309 1/20 0.33
▸ ABCG2 Q9UNQ0 1/20 0.33
▸ SLCO1B1 Q9Y6L6 1/20 0.33
▸ CYP2C8 P10632 1/20 0.30

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
SCHEMBL29527154 0.80 THRB (0.39) THRATHRBCYP2C9UGT1A1ABCG2
SCHEMBL24407945 0.76 THRB (0.59) THRATHRBCYP2C9UGT1A1ABCG2
SCHEMBL29527157 0.75 THRA (0.33) THRATHRBCYP2C9UGT1A1ABCG2
SCHEMBL29526998 0.73 THRB (0.39) THRATHRBCYP2C9UGT1A1ABCG2
SCHEMBL29066229 0.72 THRA (0.61) THRATHRBCYP2C9UGT1A1ABCG2
SCHEMBL29527046 0.71 NPBWR1 (0.34) THRATHRBCYP2C9UGT1A1ABCG2
SCHEMBL29527598 0.71 THRB (0.39) THRATHRB
SCHEMBL29066225 0.70 THRA (0.61) THRATHRBCYP2C9UGT1A1ABCG2
SCHEMBL29066207 0.70 THRB (0.47) THRATHRBCYP2C9UGT1A1ABCG2
SCHEMBL31258423 0.68 THRB (0.47) THRATHRBCYP2C9UGT1A1ABCG2

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
EP-4240730-A1 2-PYRIDONES AS THYROID HORMONE RECEPTOR MODULATORS Aligos Therapeutics, Inc. (US) 2023-09-13 — — EP disclosed
WO-2022099044-A1 2-PYRIDONES AS THYROID HORMONE RECEPTOR MODULATORS ALIGOS THERAPEUTICS, INC. (US) 2022-05-12 — — WO disclosed
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