SCHEMBL5458681

SCHEMBL5458681

NS(=O)(=O)NCCCCCC(=O)Nc1cnc2ccccc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 15/20 1.00
HDAC1 Q13547 10/20 0.71
HDAC2 Q92769 9/20 0.71
HDAC3 O15379 9/20 0.71
HDAC10 Q969S8 8/20 0.71
HDAC4 P56524 7/20 0.71
HDAC7 Q8WUI4 7/20 0.71
HDAC11 Q96DB2 7/20 0.71
HDAC8 Q9BY41 7/20 0.71
HDAC9 Q9UKV0 7/20 0.71
HDAC5 Q9UQL6 7/20 0.71
ACP1 P24666 1/20 0.50
NOTUM Q6P988 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 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
SCHEMBL5359458 0.86 HDAC6 (1.00) HDAC6HDAC1HDAC2HDAC3HDAC10
SCHEMBL10113790 0.85 HDAC6 (0.74) HDAC6HDAC1HDAC2HDAC3HDAC10
SCHEMBL10113537 0.85 HDAC6 (0.74) HDAC6HDAC1HDAC2HDAC3HDAC10
SCHEMBL5578205 0.83 HDAC1 (1.00) HDAC6HDAC1HDAC2HDAC3HDAC10
SCHEMBL15477455 0.81 HDAC1 (0.81) HDAC6HDAC1HDAC2HDAC3HDAC10
SCHEMBL10207297 0.81 HDAC1 (1.00) HDAC6HDAC1HDAC2HDAC3HDAC10
SCHEMBL30444576 0.81 HDAC1 (0.81) HDAC6HDAC1HDAC2HDAC3HDAC10
SCHEMBL30858828 0.79 HDAC6 (0.73) HDAC6HDAC1HDAC2HDAC3HDAC10
SCHEMBL5326902 0.79 HDAC6 (1.00) HDAC6HDAC1HDAC2HDAC3HDAC10
SCHEMBL29221845 0.79 HDAC6 (0.73) HDAC6HDAC1HDAC2HDAC3HDAC10

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
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
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 1/4885HDAC2 6/4885

“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.