SCHEMBL29965303

SCHEMBL29965303

COc1ccc(COc2cnc(Oc3c(Cl)cc(Br)cc3Cl)cc2S(=O)(=O)N(C)Cc2ccc(OC)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 2/20 0.46
▸ CYP19A1 P11511 1/20 0.35
▸ KEAP1 Q14145 3/20 0.35
▸ NFE2L2 Q16236 3/20 0.35
▸ CCR5 P51681 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ LRRK2 Q5S007 1/20 0.34
▸ NR1H2 P55055 1/20 0.34
▸ NR1H3 Q13133 1/20 0.34
▸ APLNR P35414 4/20 0.33
▸ L3MBTL1 Q9Y468 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
SCHEMBL23663283 1.00 ACLY (0.46) ACLYCYP19A1KEAP1NFE2L2CCR5
SCHEMBL26414397 0.79 LRRK2 (0.37) CCR5KDM4ELMNACYP1A2POLB
SCHEMBL29965753 0.79 THRB (0.39) ACLYKEAP1NFE2L2CYP2C9NR1H2
SCHEMBL23663424 0.79 THRB (0.39) ACLYKEAP1NFE2L2CYP2C9NR1H2
SCHEMBL23663400 0.76 MAPK14 (0.38) ACLYCCR5KDM4ELRRK2
SCHEMBL23663229 0.74 KEAP1 (0.44) KEAP1NFE2L2LMNA
SCHEMBL30611100 0.74 KEAP1 (0.44) KEAP1NFE2L2LMNA
SCHEMBL30611096 0.74 ALDH1A1 (0.47) ACLYKEAP1NFE2L2CCR5KDM4E
SCHEMBL23663073 0.74 ALDH1A1 (0.47) ACLYKEAP1NFE2L2CCR5KDM4E
SCHEMBL23663114 0.74 ALDH1A1 (0.42) ACLYKEAP1NFE2L2KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250320197-A1 THYROID HORMONE RECEPTOR AGONISTS AND USE THEREOF ECCOGENE INC (US) 2025-10-16 — — US disclosed
US-12291518-B2 Thyroid hormone receptor agonists and use thereof ECCOGENE INC. (US) 2025-05-06 — — US disclosed
CN-115244037-B Substituted triazinones as thyroid hormone receptor agonists 诚益生物(美国)公司 2024-10-25 — — CN disclosed
US-11780825-B2 Thyroid hormone receptor agonists and use thereof ECCOGENE (SHANGHAI) CO., LTD. (CN) 2023-10-10 — — US disclosed
EP-4090652-A1 SUBSTITUTED TRIAZINONES AS THYROID HORMONE RECEPTOR AGONISTS Eccogene (Shanghai) Co., Ltd. (CN) 2022-11-23 — — EP disclosed
CN-115244037-A Substituted triazinones as thyroid hormone receptor agonists 上海诚益生物科技有限公司 2022-10-25 — — CN 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 (3 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-11780825-B2 Thyroid hormone receptor agonists and use thereof TSHR, THRA, THRB ACLY 4220/4885CYP19A1 229/4885KEAP1 3434/4885
US-12291518-B2 Thyroid hormone receptor agonists and use thereof TSHR, THRA, THRB ACLY 4220/4885CYP19A1 229/4885KEAP1 3434/4885
US-20250320197-A1 THYROID HORMONE RECEPTOR AGONISTS AND USE THEREOF TSHR, THRA, THRB ACLY 4220/4885CYP19A1 229/4885KEAP1 3434/4885

“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.

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