SCHEMBL7953107

SCHEMBL7953107

CCC(=O)c1ccc(C(=O)Nc2ccccc2Nc2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.51
MAPT P10636 4/20 0.50
HDAC3 O15379 4/20 0.50
HDAC1 Q13547 4/20 0.50
HDAC2 Q92769 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
NCOR2 Q9Y618 2/20 0.50
GAA P10253 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
KCNK3 O14649 1/20 0.50
KCNK9 Q9NPC2 1/20 0.50
F10 P00742 1/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
POLB P06746 2/20 0.47
HPGD P15428 2/20 0.47
HDAC8 Q9BY41 2/20 0.47
HDAC6 Q9UBN7 2/20 0.47
HDAC4 P56524 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47

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
SCHEMBL6140750 0.84 SIRT2 (0.59) SIRT2MAPTHDAC3HDAC1HDAC2
SCHEMBL338745 0.81 SIRT2 (0.56) SIRT2HDAC3HDAC1HDAC2NCOR2
SCHEMBL27540427 0.81 MAPT (0.68) MAPTHDAC3HDAC1HDAC2SMN1; SMN2
SCHEMBL1366907 0.81 PTPN1 (0.60) SIRT2MAPTHDAC3HDAC1HDAC2
SCHEMBL339194 0.80 MEN1 (0.71) SIRT2MAPTHDAC3HDAC1HDAC2
SCHEMBL9696775 0.80 CACNA1B (0.67) MAPTHDAC3HDAC1HDAC2SMN1; SMN2
SCHEMBL7752677 0.79 F10 (0.79) MAPTHDAC3HDAC1HDAC2SMN1; SMN2
SCHEMBL14281039 0.79 TOP1 (0.58) SIRT2MAPTHDAC3HDAC1HDAC2
SCHEMBL15770775 0.76 MEN1 (0.53) SIRT2MAPTHDAC3HDAC1HDAC2
SCHEMBL28100858 0.76 MAPK13 (0.65) SIRT2MAPTHDAC3HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009137462-A2 METHODS FOR TREATING COGNITIVE DISORDERS USING INHIBITORS OF HISTONE DEACETYLASE ENVIVO PHARMACEUTICALS, INC. (US) 2009-11-12 WO disclosed
WO-2008055068-A2 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2008-05-08 WO disclosed