SCHEMBL4579866

SCHEMBL4579866

CC(C)(C)OC(=O)Nc1ccc(-c2cccs2)cc1NC(=O)c1ccc2c(c1)CCCN2C(=O)OCc1cccnc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 17/20 0.50
HDAC2 Q92769 9/20 0.50
HDAC3 O15379 6/20 0.50
HDAC8 Q9BY41 1/20 0.50
TP53 P04637 2/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.37

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
SCHEMBL4577465 0.88 HDAC1 (0.63) HDAC1HDAC2HDAC3HDAC8
SCHEMBL4579868 0.83 HDAC1 (0.41) HDAC1HDAC2HDAC3HDAC8TP53
SCHEMBL14155991 0.81 HDAC1 (0.63) HDAC1HDAC2HDAC3HDAC8LMNA
SCHEMBL3642910 0.80 HDAC1 (0.76) HDAC1HDAC2HDAC3HDAC8
SCHEMBL4577475 0.77 HDAC1 (0.44) HDAC1HDAC2HDAC3HDAC8POLB
SCHEMBL8292317 0.76 HDAC1 (0.56) HDAC1HDAC2HDAC3HDAC8
SCHEMBL8228809 0.76 HDAC1 (0.61) HDAC1HDAC2HDAC3HDAC8LMNA
SCHEMBL3642412 0.75 HDAC1 (0.73) HDAC1HDAC2HDAC3HDAC8
SCHEMBL4580814 0.74 PDK1 (0.52) HDAC1HDAC8POLBMAPT
SCHEMBL4579112 0.74 NPC1 (0.49) HDAC8LMNAPOLBMAPT

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2007720-B1 BENZAMIDE DERIVATIVES AS INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC (CA) 2013-12-25 EP disclosed
US-8598168-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2013-12-03 US disclosed
EP-2007720-A1 BENZAMIDE DERIVATIVES AS INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2008-12-31 EP disclosed
US-20080132503-A1 Inhibitors of Histone Deacetylase METHYLGENE INC. (CA) 2008-06-05 US disclosed
US-20080132503-A1 Inhibitors of Histone Deacetylase METHYLGENE INC. (CA) 2008-06-05 US disclosed
WO-2007118137-A1 BENZAMIDE DERIVATIVES AS INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2007-10-18 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-20080132503-A1 Inhibitors of Histone Deacetylase HDAC1, HDAC5, HDAC3 HDAC1 1/4885HDAC2 5/4885HDAC3 3/4885

“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.