SCHEMBL1362152

SCHEMBL1362152

CCCN1C(=O)C(CS)N(CC(C)C)C1=O

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 4/20 0.39
PIK3CD O00329 1/20 0.34
PDE4B Q07343 2/20 0.34
PDE7A Q13946 1/20 0.34
PDE4A P27815 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 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
SCHEMBL1362922 0.87 PIK3CD (0.36) HDAC6PIK3CDPDE4BPDE7A
SCHEMBL1362258 0.85 PDE4A (0.39) HDAC6PDE4BPDE4APDE4CPDE4D
SCHEMBL1363979 0.83 PDE4A (0.35) HDAC6PDE4BPDE4APDE4CPDE4D
SCHEMBL1362193 0.81 HDAC6 (0.36) HDAC6PIK3CDPDE4BPDE7APDE4A
SCHEMBL1363030 0.81 GAA (0.44) HDAC6PDE4BPDE4APDE4CPDE4D
SCHEMBL1362629 0.80 PDE4B (0.47) PIK3CDPDE4BPDE7A
SCHEMBL1362211 0.79 HDAC6 (0.32) HDAC6
SCHEMBL1362112 0.77 HDAC6 (0.37) HDAC6PDE4BPDE4APDE4CPDE4D
SCHEMBL1363966 0.76 TP53 (0.33) HDAC6PDE4BPDE4APDE4CPDE4D
SCHEMBL1363041 0.71 TP53 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8066977-B2 Agent for permanent hair waving containing heterocyclic mercapto compound SHOWA DENKO K.K. (JP) 2011-11-29 US disclosed
EP-1883454-B1 AGENT FOR PERMANENT HAIR WAVING CONTAINING HETEROCYCLIC MERCAPTO COMPOUND SHOWA DENKO KK (JP) 2009-11-04 EP disclosed
US-20090208439-A1 Agent for Permanent Hair Waving Containing Heterocyclic Mercapto Compound SHOWA DENKO K.K. (JP) 2009-08-20 US disclosed
EP-1883454-A2 AGENT FOR PERMANENT HAIR WAVING CONTAINING HETEROCYCLIC MERCAPTO COMPOUND Showa Denko K.K. (JP) 2008-02-06 EP disclosed
WO-2006126729-A2 AGENT FOR PERMANENT HAIR WAVING CONTAINING HETEROCYCLIC MERCAPTO COMPOUND SHOWA DENKO K.K. (JP) 2006-11-30 WO 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-20090208439-A1 Agent for Permanent Hair Waving Containing Heterocyclic Mercapto Compound NSD3, WNT3, MSRB3 HDAC6 660/4885PIK3CD 4863/4885PDE4B 4539/4885

“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.