SCHEMBL1065308

SCHEMBL1065308

Nc1ccccc1NC(=O)/C=C\c1ccc(NCc2cccnc2)cc1

nearest known ligand 0.79

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 15/20 0.79
HDAC4 P56524 5/20 0.64
MEF2D Q14814 5/20 0.64
EP300 Q09472 3/20 0.64
HDAC3 O15379 1/20 0.60
HDAC6 Q9UBN7 1/20 0.60
NAMPT P43490 1/20 0.59

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
SCHEMBL1065310 1.00 HDAC1 (0.79) HDAC1HDAC4MEF2DEP300HDAC3
SCHEMBL8346209 1.00 HDAC1 (0.79) HDAC1HDAC4MEF2DEP300HDAC3
SCHEMBL8348789 0.88 HDAC1 (0.83) HDAC1HDAC4MEF2DEP300NAMPT
SCHEMBL1065123 0.88 HDAC1 (0.83) HDAC1HDAC4MEF2DEP300NAMPT
SCHEMBL1065125 0.88 HDAC1 (0.83) HDAC1HDAC4MEF2DEP300NAMPT
SCHEMBL1064078 0.84 HDAC1 (0.92) HDAC1HDAC4MEF2DEP300HDAC3
SCHEMBL8349052 0.84 HDAC1 (0.92) HDAC1HDAC4MEF2DEP300HDAC3
SCHEMBL1064076 0.84 HDAC1 (0.92) HDAC1HDAC4MEF2DEP300HDAC3
SCHEMBL1062995 0.84 HDAC4 (0.81) HDAC1HDAC4MEF2DHDAC3HDAC6
SCHEMBL12934184 0.84 HDAC4 (0.81) HDAC1HDAC4MEF2DHDAC3HDAC6

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
US-7868204-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2011-01-11 US disclosed
US-7838520-B2 Inhibitors of histone deacetylase METHYLGENE, INC. (CA) 2010-11-23 US disclosed
US-7595343-B2 Inhibitors of histone deacetylase METHYLGENE, INC. (CA) 2009-09-29 US disclosed
US-20060058298-A1 Inhibitors of histone deacetylase METHYLGENE, INC. 2006-03-16 US disclosed
US-20050288282-A1 Inhibitors of histone deacetylase METHYLGENE, INC. 2005-12-29 US disclosed
US-6897220-B2 Inhibitors of histone deacetylase METHYLGENE, INC. (CA) 2005-05-24 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 (2 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-20050288282-A1 Inhibitors of histone deacetylase HDAC1, HDAC5, HDAC3 HDAC1 1/4885HDAC4 8/4885MEF2D 1367/4885
US-20060058298-A1 Inhibitors of histone deacetylase HDAC1, HDAC5, HDAC3 HDAC1 1/4885HDAC4 8/4885MEF2D 1367/4885

“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.