SCHEMBL5998948

SCHEMBL5998948

CC(=O)SCC(=O)NCCCCCC(=O)Nc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.80

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 17/20 0.80
HDAC4 P56524 17/20 0.80
HDAC1 Q13547 17/20 0.80
HDAC7 Q8WUI4 17/20 0.80
HDAC2 Q92769 17/20 0.80
HDAC10 Q969S8 17/20 0.80
HDAC11 Q96DB2 17/20 0.80
HDAC8 Q9BY41 17/20 0.80
HDAC6 Q9UBN7 17/20 0.80
HDAC9 Q9UKV0 17/20 0.80
HDAC5 Q9UQL6 17/20 0.80
RNF4 P78317 1/20 0.54
LTA4H P09960 1/20 0.50

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
SCHEMBL8272105 0.91 HDAC3 (0.67) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL5998508 0.90 HDAC1 (1.00) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL8228208 0.87 HDAC1 (0.86) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL5999028 0.87 HDAC1 (0.74) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL5999119 0.87 HDAC8 (0.74) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL8272561 0.83 HDAC3 (0.79) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL6038174 0.83 HDAC3 (0.56) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL8272148 0.82 HDAC8 (0.77) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL6000067 0.82 HDAC3 (0.77) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL5998809 0.82 HDAC8 (0.77) HDAC3HDAC4HDAC1HDAC7HDAC2

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-20060047123-A1 Mercaptoamides as histone deacetylase inhibitors AHMED SALEH 2006-03-02 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-20060047123-A1 Mercaptoamides as histone deacetylase inhibitors HDAC1, HDAC11, HDAC2 HDAC3 7/4885HDAC4 12/4885HDAC1 1/4885

“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.