SCHEMBL1263152

SCHEMBL1263152

C=CC(=O)NCc1ccc(NCCCCCCCCCCCCCCCCCC)cc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.56
ZDHHC2 Q9UIJ5 1/20 0.56
THRA P10827 4/20 0.56
THRB P10828 4/20 0.56
TGM2 P21980 1/20 0.52
HDAC3 O15379 6/20 0.45
HDAC1 Q13547 4/20 0.45
HDAC2 Q92769 4/20 0.45
HDAC8 Q9BY41 2/20 0.45
HDAC11 Q96DB2 1/20 0.43
EPHX2 P34913 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL1263550 1.00 ZDHHC20 (0.56) ZDHHC20ZDHHC2THRATHRBTGM2
SCHEMBL1262261 0.83 THRA (0.69) ZDHHC20ZDHHC2THRATHRBTGM2
SCHEMBL1263093 0.83 THRA (0.69) ZDHHC20ZDHHC2THRATHRBTGM2
SCHEMBL221394 0.81 HDAC3 (0.48) THRATHRBHDAC3HDAC1HDAC2
SCHEMBL219072 0.81 HDAC3 (0.48) THRATHRBHDAC3HDAC1HDAC2
SCHEMBL19856028 0.78 THRB (0.62) ZDHHC20ZDHHC2THRATHRBTGM2
SCHEMBL1262225 0.77 THRB (0.48) ZDHHC20ZDHHC2THRATHRBTGM2
SCHEMBL1262785 0.77 THRB (0.48) ZDHHC20ZDHHC2THRATHRBTGM2
SCHEMBL732934 0.77 TGM2 (0.81) TGM2MEN1KMT2A
Bromide SCHEMBL28122058 0.76 THRB (0.62) ZDHHC20ZDHHC2THRATHRBTGM2

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
US-7881648-B2 Positive charge control resin for electrophotographic functional component parts, developing roller, and electrophotographic apparatus CANON KASEI KABUSHIKI KAISHA (JP) 2011-02-01 US disclosed
US-20080247787-A1 Positive Charge Control Resin for Electrophotographic Functional Component Parts, Developing Roller, and Electrophotographic Apparatus CANON KASEI KABUSHIKI KAISHA (JP) 2008-10-09 US disclosed
WO-2006134788-A1 POSITIVE CHARGE CONTROL RESIN FOR ELECTROPHOTOGRAPHIC FUNCTIONAL COMPONENT PARTS, DEVELOPING ROLLER, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KASEI KABUSHIKI KAISHA (JP) 2006-12-21 WO disclosed