SCHEMBL19978557

SCHEMBL19978557

C[C@@H]1C[C@H]2C(=O)O[C@@H](C)CC(=O)N3C[C@H](O)C[C@H]3C(=O)N3CCCC[C@H]3C(=O)N[C@@H](C)C(=O)N2C1

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40

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
SCHEMBL21650049 1.00 HDAC4 (0.40) HDAC4HDAC1
SCHEMBL19943418 1.00 HDAC4 (0.40) HDAC4HDAC1
SCHEMBL24590922 0.93 HDAC4 (0.44) HDAC4HDAC1
SCHEMBL24590889 0.92 HDAC4 (0.44) HDAC4HDAC1
SCHEMBL24590858 0.91 HDAC4 (0.43) HDAC4HDAC1
SCHEMBL20611641 0.90 HDAC4 (0.45) HDAC4HDAC1
SCHEMBL19819244 0.90 HDAC4 (0.45) HDAC4HDAC1
SCHEMBL20611590 0.90 HDAC4 (0.45) HDAC4HDAC1
SCHEMBL19943404 0.90 HDAC4 (0.45) HDAC4HDAC1
SCHEMBL20611440 0.90 HDAC4 (0.45) HDAC4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10822377-B2 Substituted urea depsipeptide analogs as activators of the ClpP endopeptidase ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2020-11-03 — — US disclosed
US-10570179-B2 Substituted urea depsipeptide analogs as activators of the CLPP endopeptidase ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2020-02-25 — — US disclosed
US-20200031872-A1 Substituted Urea Depsipeptide Analogs as Activators of the CLPP Endopeptidase ST. JUDE CHILDREN'S RESEARCH HOSPITAL 2020-01-30 — — US disclosed
US-10457707-B2 Substituted urea depsipeptide analogs as activators of the CLPP endopeptidase ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2019-10-29 — — US disclosed
US-20190185517-A1 SUBSTITUTED UREA DEPSIPEPTIDE ANALOGS AS ACTIVATORS OF THE CLPP ENDOPEPTIDASE NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2019-06-20 — — US disclosed
US-20190048040-A1 Substituted Urea Depsipeptide Analogs as Activators of the CLPP Endopeptidase ST JUDE CHILDRENS RES HOSPITAL (US) 2019-02-14 — — US disclosed
US-20180079784-A1 Substituted Urea Depsipeptide Analogs as Activators of the CLPP Endopeptidase ST.JUDE CHILDREN'S RESEARCH HOSPITAL 2018-03-22 — — US 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 (7 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-10570179-B2 Substituted urea depsipeptide analogs as activators of the CLPP endopeptidase CLPP, DNPEP, PEPD HDAC4 1924/4885HDAC1 1762/4885
US-10457707-B2 Substituted urea depsipeptide analogs as activators of the CLPP endopeptidase CLPP, DNPEP, PEPD HDAC4 1924/4885HDAC1 1762/4885
US-20180079784-A1 Substituted Urea Depsipeptide Analogs as Activators of the CLPP Endopeptidase CLPP, PEPD, DNPEP HDAC4 2000/4885HDAC1 1861/4885
US-10822377-B2 Substituted urea depsipeptide analogs as activators of the ClpP endopeptidase CLPP, DNPEP, PEPD HDAC4 1924/4885HDAC1 1762/4885
US-20190185517-A1 SUBSTITUTED UREA DEPSIPEPTIDE ANALOGS AS ACTIVATORS OF THE CLPP ENDOPEPTIDASE CLPP, DNPEP, PEPD HDAC4 1924/4885HDAC1 1762/4885
US-20190048040-A1 Substituted Urea Depsipeptide Analogs as Activators of the CLPP Endopeptidase CLPP, DNPEP, PEPD HDAC4 1924/4885HDAC1 1762/4885
US-20200031872-A1 Substituted Urea Depsipeptide Analogs as Activators of the CLPP Endopeptidase CLPP, DNPEP, PEPD HDAC4 1924/4885HDAC1 1762/4885

“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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