SCHEMBL5329050

SCHEMBL5329050

CC(C)(C)OC(=O)NCCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(-c2ccccc2)cs1

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 13/20 0.70
HDAC2 Q92769 13/20 0.70
HDAC6 Q9UBN7 13/20 0.70
HDAC3 O15379 12/20 0.70
HDAC4 P56524 12/20 0.70
HDAC7 Q8WUI4 12/20 0.70
HDAC10 Q969S8 12/20 0.70
HDAC11 Q96DB2 12/20 0.70
HDAC8 Q9BY41 12/20 0.70
HDAC9 Q9UKV0 12/20 0.70
HDAC5 Q9UQL6 12/20 0.70
SIRT2 Q8IXJ6 5/20 0.53
SIRT1 Q96EB6 3/20 0.53
SIRT3 Q9NTG7 3/20 0.53

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
SCHEMBL3958560 0.99 HDAC6 (0.71) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL5322695 0.89 HDAC6 (0.74) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL8068180 0.89 HDAC6 (0.75) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL5326807 0.87 HDAC4 (0.66) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL5326808 0.87 HDAC4 (0.66) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL8063634 0.85 HDAC6 (0.70) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL8061147 0.85 HDAC1 (0.75) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL5457700 0.85 HDAC1 (0.56) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL26614628 0.85 HDAC1 (0.56) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL8061127 0.85 HDAC1 (0.72) HDAC1HDAC2HDAC6HDAC3HDAC4

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
WO-2007143822-A1 SULFAMIDE AND SULFAMATE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS METHYLGENE INC. (CA) 2007-12-21 WO disclosed
US-20070293530-A1 SULFAMIDE AND SULFAMATE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS METHYLGENE INC. (CA) 2007-12-20 US disclosed
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 HDAC1 1/4885HDAC2 6/4885HDAC6 11/4885

“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.