SCHEMBL5281150

SCHEMBL5281150

O=C(CC(O)C(=O)O)NCCCCCC(=O)Nc1cccc(-c2ccccc2)c1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 18/20 0.62
HDAC1 Q13547 18/20 0.62
HDAC3 O15379 16/20 0.61
HDAC4 P56524 15/20 0.61
HDAC7 Q8WUI4 15/20 0.61
HDAC2 Q92769 15/20 0.61
HDAC10 Q969S8 15/20 0.61
HDAC11 Q96DB2 15/20 0.61
HDAC8 Q9BY41 15/20 0.61
HDAC9 Q9UKV0 15/20 0.61
HDAC5 Q9UQL6 15/20 0.61
AURKB Q96GD4 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
SCHEMBL5278812 0.89 HDAC6 (0.58) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL5289621 0.86 HDAC6 (0.57) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL6038181 0.84 HDAC6 (0.70) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL5328660 0.84 HDAC1 (0.73) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL5240357 0.83 HDAC6 (0.78) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL6038155 0.83 HDAC6 (0.78) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL6037963 0.82 HDAC6 (0.67) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL5282313 0.82 HDAC1 (0.70) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL6038178 0.82 HDAC6 (0.76) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL5285806 0.81 HDAC6 (0.64) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1863804-A1 INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2007-12-12 EP claimed
US-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 US claimed
WO-2006102760-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2006-10-05 WO claimed
EP-1863804-A1 INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2007-12-12 EP disclosed
US-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 US disclosed
WO-2006102760-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2006-10-05 WO disclosed
WO-2006102760-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2006-10-05 WO 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-20060264415-A1 Inhibitors of histone deacetylase HDAC1, HDAC3, HDAC11 HDAC6 17/4885HDAC1 1/4885HDAC3 2/4885

“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.