SCHEMBL5330916

SCHEMBL5330916

CC(C)(C)OC(=O)NCCCC[C@H](NC(N)=S)C(=O)Nc1cccc2cccnc12

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 6/20 0.54
MEF2D Q14814 2/20 0.54
EP300 Q09472 1/20 0.54
HDAC1 Q13547 11/20 0.50
HDAC6 Q9UBN7 6/20 0.50
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
KDM4E B2RXH2 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SIRT5 Q9NXA8 1/20 0.46
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL5330900 1.00 HDAC4 (0.54) HDAC4MEF2DEP300HDAC1HDAC6
SCHEMBL5327739 0.86 KDM4E (0.50) HDAC4MEF2DEP300HDAC1HDAC6
SCHEMBL5327734 0.86 KDM4E (0.50) HDAC4MEF2DEP300HDAC1HDAC6
SCHEMBL5326792 0.85 HDAC1 (0.71) HDAC4MEF2DEP300HDAC1HDAC6
SCHEMBL5326785 0.85 HDAC1 (0.71) HDAC4MEF2DEP300HDAC1HDAC6
SCHEMBL8252976 0.85 HDAC4 (0.58) HDAC4MEF2DEP300HDAC1HDAC6
SCHEMBL8111828 0.83 HDAC1 (0.60) HDAC4MEF2DEP300HDAC1HDAC6
SCHEMBL5330903 0.82 KDM4E (0.45) HDAC4MEF2DEP300HDAC1HDAC6
SCHEMBL5331945 0.81 HDAC1 (0.47) HDAC4MEF2DEP300HDAC1HDAC6
SCHEMBL5331940 0.81 HDAC1 (0.47) HDAC4MEF2DEP300HDAC1HDAC6

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 HDAC4 12/4885MEF2D 1307/4885EP300 73/4885

“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.