SCHEMBL1363966

SCHEMBL1363966

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

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.33
GAA P10253 1/20 0.33
IDO1 P14902 1/20 0.32
HDAC6 Q9UBN7 4/20 0.31
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
CYP19A1 P11511 1/20 0.31
ADRA2C P18825 1/20 0.30
F2 P00734 1/20 0.30
ELANE P08246 1/20 0.30
CTSG P08311 1/20 0.30
CTRC Q99895 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
SCHEMBL1363028 0.86 F2 (0.41) TP53GAAHDAC6ADRA2CF2
SCHEMBL1362258 0.83 PDE4A (0.39) TP53GAAHDAC6PDE4APDE4B
SCHEMBL1363979 0.81 PDE4A (0.35) TP53GAAHDAC6PDE4APDE4B
SCHEMBL1362211 0.80 HDAC6 (0.32) HDAC6
SCHEMBL1363041 0.79 TP53 (0.30) TP53GAA
SCHEMBL1363030 0.79 GAA (0.44) TP53GAAHDAC6PDE4APDE4B
SCHEMBL1362152 0.76 HDAC6 (0.39) HDAC6PDE4APDE4BPDE4CPDE4D
SCHEMBL1361254 0.76 GAA (0.35) TP53GAAIDO1PDE4APDE4B
SCHEMBL1362112 0.74 HDAC6 (0.37) TP53GAAHDAC6PDE4APDE4B
SCHEMBL1362190 0.69 MMP1 (0.35) TP53GAAHDAC6PDE4APDE4B

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 TP53 2453/4885GAA 4854/4885IDO1 366/4885

“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.