SCHEMBL1695610

SCHEMBL1695610

Cc1cc(C)c(CNC(=O)C2=CCN(C(C)C)C(c3ccnc(N4CCOCC4)c3)=C2)c(=O)[nH]1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 20/20 0.54
EED O75530 7/20 0.54
RBBP4 Q09028 7/20 0.54
SUZ12 Q15022 7/20 0.54
RBBP7 Q16576 3/20 0.54
EZH1 Q92800 6/20 0.47
AEBP2 Q6ZN18 6/20 0.47
PRMT3 O60678 1/20 0.45
ADRA1B P35368 1/20 0.45
SETD7 Q8WTS6 1/20 0.45
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44

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
SCHEMBL1694768 0.77 EZH2 (0.73) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL1695613 0.77 EZH2 (0.48) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL12180703 0.72 EZH2 (0.85) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL1695598 0.71 EZH2 (0.87) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL27983811 0.71 EZH2 (0.62) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL16116149 0.70 EZH2 (0.64) EZH2EEDRBBP4SUZ12EZH1
SCHEMBL12180083 0.70 EZH2 (0.85) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL1695481 0.70 EZH2 (0.85) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL12684278 0.70 EZH2 (0.84) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL12180482 0.69 EZH2 (0.82) EZH2EEDRBBP4SUZ12RBBP7

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
EP-2566479-A1 AZAINDAZOLES GlaxoSmithKline LLC (US) 2013-03-13 EP disclosed
WO-2012005805-A1 AZAINDAZOLES GLAXOSMITHKLINE LLC (US) 2012-01-12 WO disclosed