SCHEMBL29381775

SCHEMBL29381775

O=C(NO)c1ccc(Cn2c(=O)n(Cc3ccccc3C(F)(F)F)c(=O)c3ccccc32)cc1

nearest known ligand 0.73

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 19/20 0.73
▸ HDAC6 Q9UBN7 19/20 0.73
▸ HDAC8 Q9BY41 17/20 0.73
▸ HDAC11 Q96DB2 14/20 0.73
▸ MELK Q14680 1/20 0.65
▸ HDAC10 Q969S8 1/20 0.58
▸ HTT P42858 1/20 0.54

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
SCHEMBL24030794 1.00 HDAC1 (0.73) HDAC1HDAC6HDAC8HDAC11MELK
SCHEMBL24030776 0.92 HDAC1 (0.75) HDAC1HDAC6HDAC8HDAC11MELK
SCHEMBL24031079 0.89 HDAC1 (0.81) HDAC1HDAC6HDAC8HDAC11MELK
SCHEMBL24030769 0.85 HDAC1 (0.69) HDAC1HDAC6HDAC8HDAC11MELK
SCHEMBL30317686 0.85 HDAC1 (0.69) HDAC1HDAC6HDAC8HDAC11MELK
SCHEMBL24031073 0.85 HDAC6 (1.00) HDAC1HDAC6HDAC8HDAC11MELK
SCHEMBL24031153 0.84 HDAC1 (0.77) HDAC1HDAC6HDAC8HDAC11MELK
SCHEMBL24031447 0.84 HDAC1 (0.64) HDAC1HDAC6HDAC8HDAC11MELK
SCHEMBL24030765 0.83 HDAC6 (0.88) HDAC1HDAC6HDAC8HDAC11MELK
SCHEMBL24247609 0.83 TSHR (0.59) HTT

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
CN-110621317-B Inhibitors of Histone Deacetylase (HDACS) 安基生技新药股份有限公司 2023-05-12 — — CN disclosed
US-11535598-B2 Histone deacetylases (HDACs) inhibitors Annji Pharmaceutical Co., Ltd. (TW) 2022-12-27 — — US disclosed
EP-3624804-B1 HISTONE DEACETYLASES (HDACS) INHIBITORS ANNJI PHARM CO LTD (TW) 2022-02-16 — — 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-11535598-B2 Histone deacetylases (HDACs) inhibitors HDAC1, HDAC3, HDAC2 HDAC1 1/4885HDAC6 11/4885HDAC8 6/4885

“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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