SCHEMBL8347900

SCHEMBL8347900

Nc1ccccc1NC(=O)/C=C/c1ccc(NCc2cccc(OC(F)(F)F)c2)cc1

nearest known ligand 0.81

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 10/20 0.81
HDAC4 P56524 10/20 0.66
MEF2D Q14814 10/20 0.66
EP300 Q09472 5/20 0.66

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
SCHEMBL1064610 1.00 HDAC1 (0.81) HDAC1HDAC4MEF2DEP300
SCHEMBL1064612 1.00 HDAC1 (0.81) HDAC1HDAC4MEF2DEP300
SCHEMBL1062860 0.91 HDAC1 (0.81) HDAC1HDAC4MEF2DEP300
SCHEMBL1062857 0.91 HDAC1 (0.81) HDAC1HDAC4MEF2DEP300
SCHEMBL8346179 0.91 HDAC1 (0.81) HDAC1HDAC4MEF2DEP300
SCHEMBL1064046 0.90 HDAC1 (1.00) HDAC1HDAC4MEF2DEP300
SCHEMBL8346349 0.90 HDAC1 (1.00) HDAC1HDAC4MEF2DEP300
SCHEMBL1064049 0.90 HDAC1 (1.00) HDAC1HDAC4MEF2DEP300
SCHEMBL12934195 0.88 HDAC1 (0.82) HDAC1HDAC4MEF2DEP300
SCHEMBL1064964 0.88 HDAC1 (0.82) HDAC1HDAC4MEF2DEP300

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 9 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-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-7838520-B2 Inhibitors of histone deacetylase METHYLGENE, INC. (CA) 2010-11-23 US disclosed
EP-1590340-B1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC (CA) 2010-04-07 EP disclosed
US-7595343-B2 Inhibitors of histone deacetylase METHYLGENE, INC. (CA) 2009-09-29 US disclosed
US-7595343-B2 Inhibitors of histone deacetylase METHYLGENE, INC. (CA) 2009-09-29 US disclosed
WO-2004069823-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE, INC. (CA) 2004-08-19 WO disclosed
WO-2003024448-A2 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE, INC. (CA) 2003-03-27 WO disclosed