SCHEMBL5082083

SCHEMBL5082083

CC(C)(C)OC(=O)CCC1C(=O)Nc2ccccc2N1Cc1ccc(C(=O)NO)cc1

nearest known ligand 0.74

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 19/20 0.74
HDAC8 Q9BY41 14/20 0.74
HDAC2 Q92769 11/20 0.74
HDAC1 Q13547 6/20 0.47
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HDAC11 Q96DB2 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41

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
SCHEMBL5082088 1.00 HDAC6 (0.74) HDAC6HDAC8HDAC2HDAC1MEN1
SCHEMBL5579701 0.86 HDAC6 (0.81) HDAC6HDAC8HDAC2HDAC1
SCHEMBL5079002 0.85 HDAC6 (1.00) HDAC6HDAC8HDAC2HDAC1MEN1
SCHEMBL5078998 0.85 HDAC6 (1.00) HDAC6HDAC8HDAC2HDAC1MEN1
SCHEMBL5081596 0.82 HDAC6 (1.00) HDAC6HDAC8HDAC2HDAC1
SCHEMBL5579372 0.82 HDAC6 (1.00) HDAC6HDAC8HDAC2HDAC1
SCHEMBL5077671 0.82 HDAC6 (1.00) HDAC6HDAC8HDAC2HDAC1
SCHEMBL5077668 0.82 HDAC6 (1.00) HDAC6HDAC8HDAC2HDAC1
SCHEMBL5082166 0.80 HDAC6 (1.00) HDAC6HDAC8HDAC2HDAC1
SCHEMBL5078399 0.80 HDAC6 (1.00) HDAC6HDAC8HDAC2HDAC1

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
EP-1940805-A1 BENZODIAZEPINE AND BENZOPIPERAZINE ANALOG INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2008-07-09 EP claimed
WO-2007022638-A1 BENZODIAZEPINE AND BENZOPIPERAZINE ANALOG INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2007-03-01 WO claimed
US-20070155730-A1 Benzodiazepine And Benzopiperazine Analog Inhibitors Of Histone Deacetylase METHYLGENE, INC. (CA) 2007-07-05 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-20070155730-A1 Benzodiazepine And Benzopiperazine Analog Inhibitors Of Histone Deacetylase HDAC5, HDAC4, HDAC3 HDAC6 24/4885HDAC8 9/4885HDAC2 4/4885

“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.