SCHEMBL8105909

SCHEMBL8105909

NS(=O)(=O)NCCCC[C@H](NC(=O)OCc1ccccc1)c1nc2cc(-c3ccncc3)ccc2[nH]1

nearest known ligand 0.77

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 18/20 0.77
HDAC1 Q13547 17/20 0.77
HDAC3 O15379 15/20 0.77
HDAC4 P56524 15/20 0.77
HDAC7 Q8WUI4 15/20 0.77
HDAC2 Q92769 15/20 0.77
HDAC10 Q969S8 15/20 0.77
HDAC11 Q96DB2 15/20 0.77
HDAC8 Q9BY41 15/20 0.77
HDAC9 Q9UKV0 15/20 0.77
HDAC5 Q9UQL6 15/20 0.77
AAK1 Q2M2I8 2/20 0.49

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
SCHEMBL8120476 0.89 HDAC6 (0.82) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL8115559 0.87 HDAC6 (1.00) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL8115673 0.86 HDAC6 (0.79) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL8113468 0.83 HDAC6 (1.00) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL17515943 0.81 AAK1 (0.71) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL14345756 0.78 HDAC6 (0.92) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL5466458 0.76 HDAC6 (0.69) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL8110732 0.75 HDAC6 (0.64) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL14345697 0.75 HDAC6 (0.89) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL14345610 0.75 HDAC6 (0.79) HDAC6HDAC1HDAC3HDAC4HDAC7

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 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.