SCHEMBL58810

SCHEMBL58810

Cc1nn(-c2nc(O)nc(-n3nc(C)c(N=Nc4c(C#N)cnn4-c4cc(C(=O)O)cc(C(=O)O)c4)c3N)n2)c(N)c1N=Nc1c(C#N)cnn1-c1cc(C(=O)O)cc(C(=O)O)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 2/20 0.41
SMN1; SMN2 Q16637 6/20 0.36
MAPT P10636 5/20 0.36
RAB9A P51151 5/20 0.36
TDP1 Q9NUW8 5/20 0.36
NPC1 O15118 4/20 0.36
KMT2A Q03164 4/20 0.36
MAPK1 P28482 3/20 0.36
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 3/20 0.33
HPGD P15428 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
ALOX12 P18054 1/20 0.33
HTT P42858 1/20 0.33
GLA P06280 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
AR P10275 2/20 0.31
LMNA P02545 2/20 0.31
TSHR P16473 1/20 0.31
F2 P00734 1/20 0.31

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
SCHEMBL13762788 0.94 XDH (0.36) XDHSMN1; SMN2MAPTRAB9ATDP1
SCHEMBL12552951 0.93 XDH (0.38) XDHSMN1; SMN2MAPTRAB9ATDP1
SCHEMBL10052067 0.93 XDH (0.36) XDHSMN1; SMN2MAPTRAB9ATDP1
SCHEMBL10139559 0.93 XDH (0.36) XDHSMN1; SMN2MAPTRAB9ATDP1
SCHEMBL12052399 0.93 XDH (0.38) XDHSMN1; SMN2MAPTRAB9ATDP1
SCHEMBL4398093 0.92 XDH (0.37) XDHSMN1; SMN2MAPTRAB9ATDP1
SCHEMBL12998805 0.90 XDH (0.37) XDHSMN1; SMN2MAPTRAB9ATDP1
SCHEMBL12998697 0.90 XDH (0.37) XDHSMN1; SMN2MAPTRAB9ATDP1
SCHEMBL15233455 0.90 XDH (0.39) XDH
SCHEMBL13456834 0.89 XDH (0.39) XDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9315686-B2 Water-based ink for ink-jet recording, water-based ink set for ink-jet recording, ink cartridge, and ink-jet recording method BROTHER KOGYO KABUSHIKI KAISHA (JP) 2016-04-19 US disclosed
US-9056997-B2 Ink-jet recording apparatus, ink-jet recording method, recorded matter and composite black BROTHER KOGYO KABUSHIKI KAISHA (JP) 2015-06-16 US disclosed
US-9033483-B2 Water-based ink set for ink-jet recording, water-based ink, and ink-jet recording method BROTHER KOGYO KABUSHIKI KAISHA (JP) 2015-05-19 US disclosed
US-20150116392-A1 Ink-Jet Recording Apparatus, Ink-Jet Recording Method, Recorded Matter and Composite Black BROTHER KOGYO KABUSHIKI KAISHA (JP) 2015-04-30 US disclosed
US-8864297-B2 Water-based ink set for ink-jet recording, ink-jet recording method and ink-jet recording apparatus BROTHER KOGYO KABUSHIKI KAISHA (JP) 2014-10-21 US disclosed
US-20140292901-A1 Water-Based Ink for Ink-Jet Recording, Water-Based Ink Set for Ink-Jet Recording, Ink Cartridge, and Ink-Jet Recording Method BROTHER KOGYO KABUSHIKI KAISHA (JP) 2014-10-02 US disclosed
US-20130182054-A1 Water-Based Ink Set For Ink-Jet Recording, Ink-Jet Recording Method and Ink-Jet Recording Apparatus BROTHER KOGYO KABUSHIKI KAISHA (JP) 2013-07-18 US disclosed
US-8460449-B2 Water-based ink set for ink jet recording, ink cartridge, and ink-jet recording apparatus BROTHER KOGYO KABUSHIKI KAISHA (JP) 2013-06-11 US disclosed
US-20130083145-A1 Water-Based Ink Set for Ink-Jet Recording, Water-Based Ink, and Ink-Jet Recording Method BROTHER KOGYO KABUSHIKI KAISHA (JP) 2013-04-04 US disclosed
US-8282719-B2 Water-based ink for ink-jet recording, ink cartridge, ink-jet recording apparatus and method of stabilizing water-based ink for ink-jet recording BROTHER KOGYO KABUSHIKI KAISHA (JP) 2012-10-09 US disclosed
US-20120192759-A1 Water-Based Ink for Ink-Jet Recording, Ink Cartridge, Ink-Jet Recording Apparatus and Method of Stabilizing Water-Based Ink for Ink-Jet Recording BROTHER KOGYO KABUSHIKI KAISHA (JP) 2012-08-02 US disclosed
US-20120081453-A1 WATER-BASED INK SET FOR INK-JET RECORDING, INK-JET RECORDING METHOD, AND INK-JET RECORDING APPARATUS BROTHER KOGYO KABUSHIKI KAISHA (JP) 2012-04-05 US disclosed
US-8128747-B2 Water-based ink for ink-jet recording, ink cartridge and ink-jet recording apparatus BROTHER KOGYO KABUSHIKI KAISHA (JP) 2012-03-06 US disclosed
US-8114208-B2 Ink jet ink, ink jet recording method, ink cartridge, recording unit and ink jet recording apparatus CANON KABUSHIKI KAISHA (JP) 2012-02-14 US disclosed
US-20110128333-A1 Water-Based Ink Set for Ink Jet Recording, Ink Cartridge, and Ink-Jet Recording Apparatus BROTHER KOGYO KABUSHIKI KAISHA (JP) 2011-06-02 US disclosed
US-20090274839-A1 INK JET INK, INK JET RECORDING METHOD, INK CARTRIDGE, RECORDING UNIT AND INK JET RECORDING APPARATUS CANON KABUSHIKI KAISHA (JP) 2009-11-05 US disclosed
US-20090165672-A1 Water-Based Ink for Ink-Jet Recording, Ink Cartridge and Ink-Jet Recording Apparatus BROTHER KOGYO KABUSHIKI KAISHA (JP) 2009-07-02 US disclosed
US-7553358-B2 Ink jet ink, ink jet recording method, ink cartridge, recording unit and ink jet recording apparatus CANON KABUSHIKI KAISHA (JP) 2009-06-30 US disclosed
US-20080274285-A1 INK JET INK, INK JET RECORDING METHOD, INK CARTRIDGE, RECORDING UNIT AND INK JET RECORDING APPARATUS CANON KABUSHIKI KAISHA (JP) 2008-11-06 US disclosed