SCHEMBL5451808

SCHEMBL5451808

O=C(O)NC(CCCCO)C(=O)Nc1nc(-c2ccccc2)cs1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 10/20 0.59
HDAC1 Q13547 9/20 0.59
HDAC4 P56524 10/20 0.59
HDAC3 O15379 8/20 0.59
HDAC7 Q8WUI4 8/20 0.59
HDAC2 Q92769 8/20 0.59
HDAC10 Q969S8 8/20 0.59
HDAC11 Q96DB2 8/20 0.59
HDAC8 Q9BY41 8/20 0.59
HDAC9 Q9UKV0 8/20 0.59
HDAC5 Q9UQL6 8/20 0.59
ELOVL1 Q9BW60 1/20 0.53
MAPT P10636 2/20 0.52
ADORA3 P0DMS8 1/20 0.52
MEF2D Q14814 2/20 0.52
EP300 Q09472 1/20 0.52
GSTO1 P78417 1/20 0.51

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
SCHEMBL5472600 0.90 HDAC6 (0.61) HDAC6HDAC1HDAC4HDAC3HDAC7
SCHEMBL21224173 0.89 HDAC6 (0.62) HDAC6HDAC1HDAC4HDAC3HDAC7
SCHEMBL5366535 0.89 HDAC6 (0.60) HDAC6HDAC1HDAC4HDAC3HDAC7
SCHEMBL8113232 0.85 HDAC6 (0.76) HDAC6HDAC1HDAC4HDAC3HDAC7
SCHEMBL3957970 0.85 HDAC6 (0.57) HDAC6HDAC1HDAC4HDAC3HDAC7
SCHEMBL5327667 0.84 HDAC6 (0.82) HDAC6HDAC1HDAC4HDAC3HDAC7
SCHEMBL5328254 0.83 HDAC6 (0.81) HDAC6HDAC1HDAC4HDAC3HDAC7
SCHEMBL3957908 0.82 HDAC6 (0.58) HDAC6HDAC1HDAC4HDAC3HDAC7
SCHEMBL21225219 0.82 ELOVL1 (0.56) HDAC6HDAC1HDAC4HDAC3HDAC7
SCHEMBL3951172 0.82 HDAC6 (0.57) HDAC6HDAC1HDAC4HDAC3HDAC7

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 1/4885HDAC4 12/4885

“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.