SCHEMBL1361262

SCHEMBL1361262

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

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.32
GAA P10253 1/20 0.32
CYP19A1 P11511 1/20 0.31
PDE4A P27815 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30
PDE4D Q08499 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
SCHEMBL1364106 0.85 F2 (0.39)
SCHEMBL1363041 0.79 TP53 (0.30) TP53GAA
SCHEMBL1361254 0.77 GAA (0.35) TP53GAACYP19A1PDE4APDE4B
SCHEMBL1362916 0.76 PDE4A (0.41) TP53GAACYP19A1PDE4APDE4B
SCHEMBL1363993 0.75
SCHEMBL1362321 0.74 PDE4A (0.31) CYP19A1PDE4APDE4BPDE4CPDE4D
SCHEMBL1362944 0.71 GAA (0.47) TP53GAACYP19A1PDE4APDE4B
SCHEMBL1362193 0.69 HDAC6 (0.36) TP53GAAPDE4APDE4BPDE4C
SCHEMBL1364181 0.67 F2 (0.39) TP53GAAPDE4APDE4BPDE4C
SCHEMBL1364177 0.64 F2 (0.37)

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
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

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 4854/4885CYP19A1 1907/4885

“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.