SCHEMBL5459176

SCHEMBL5459176

COC(=O)c1ccc(NC(=O)C(CCCCNS(N)(=O)=O)NC(=O)OCc2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 12/20 0.64
HDAC1 Q13547 10/20 0.63
HDAC3 O15379 9/20 0.63
HDAC4 P56524 9/20 0.63
HDAC7 Q8WUI4 9/20 0.63
HDAC2 Q92769 9/20 0.63
HDAC10 Q969S8 9/20 0.63
HDAC11 Q96DB2 9/20 0.63
HDAC8 Q9BY41 9/20 0.63
HDAC9 Q9UKV0 9/20 0.63
HDAC5 Q9UQL6 9/20 0.63
SIRT2 Q8IXJ6 6/20 0.57
SIRT1 Q96EB6 6/20 0.57
SIRT5 Q9NXA8 1/20 0.57
SIRT3 Q9NTG7 3/20 0.56

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
SCHEMBL5459171 1.00 HDAC6 (0.64) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL5465199 0.92 HDAC6 (0.67) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL8116601 0.91 HDAC6 (0.72) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL8116364 0.90 HDAC6 (0.69) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL8119270 0.86 HDAC6 (0.62) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL8114730 0.84 HDAC6 (0.62) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL8108042 0.84 HDAC6 (0.69) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL16144704 0.79 SIRT2 (0.62) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL1160192 0.79 SIRT5 (0.68) SIRT2SIRT1SIRT5SIRT3
SCHEMBL12877577 0.79 SIRT5 (0.68) SIRT2SIRT1SIRT5SIRT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070293530-A1 SULFAMIDE AND SULFAMATE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS METHYLGENE INC. (CA) 2007-12-20 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-20070293530-A1 SULFAMIDE AND SULFAMATE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC11, HAT1 HDAC6 11/4885HDAC1 1/4885HDAC3 4/4885

“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.