SCHEMBL3834770

SCHEMBL3834770

C=C(C(=C)C(=O)NC(CCC)S(=O)(=O)O)C(N)=O

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HDAC7 Q8WUI4 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
HDAC9 Q9UKV0 1/20 0.31
HDAC5 Q9UQL6 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL7180189 0.87 KDM4E (0.30)
SCHEMBL310237 0.80 TGFBR1 (0.44) HDAC7HDAC8HDAC6HDAC9HDAC5
SCHEMBL14344054 0.79 HDAC7 (0.33) HDAC7HDAC8HDAC6HDAC9HDAC5
SCHEMBL6663169 0.79 HDAC7 (0.33) HDAC7HDAC8HDAC6HDAC9HDAC5
SCHEMBL38650713 0.78 HDAC7 (0.38) HDAC7HDAC8HDAC6HDAC9HDAC5
SCHEMBL232367 0.78
SCHEMBL1996834 0.72
Acrylamide SCHEMBL6055790 0.72 TSHR (0.39) HDAC7HDAC8HDAC6HDAC9HDAC5
SCHEMBL28044631 0.71 CYP2C9 (0.41) HDAC7HDAC8HDAC6HDAC9HDAC5
SCHEMBL21951 0.70 TSHR (0.44) HDAC7HDAC8HDAC6HDAC9HDAC5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0930061-B1 Oxidizing agent from a plurality of components and process for permanent hair waving using it OREAL (FR) 2004-02-25 EP claimed
US-20090041688-A1 Sunless tanning compositions comprising certain substituted polyamine compounds and methods of use DUEVA-KOGANOV OLGA 2009-02-12 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-20090041688-A1 Sunless tanning compositions comprising certain substituted polyamine compounds and methods of use SRM, TYR, XPA HDAC7 1506/4885HDAC8 2050/4885HDAC6 4158/4885

“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.