SCHEMBL1309656

SCHEMBL1309656

NCCCC[C@@H]([C]=O)NCC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.41
RNPEP Q9H4A4 1/20 0.40
FOLH1 Q04609 1/20 0.39
CYP2D6 P10635 1/20 0.38
NFKB1 P19838 1/20 0.38
CPB2 Q96IY4 5/20 0.37
BLM P54132 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
LMNA P02545 2/20 0.36
THRB P10828 2/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
PLG P00747 1/20 0.36
ALOX15 P16050 1/20 0.36
SLC6A2 P23975 1/20 0.36
RECQL P46063 1/20 0.36
SLC6A3 Q01959 1/20 0.36
GABRR3 A8MPY1 1/20 0.34
GABRP O00591 1/20 0.34

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
SCHEMBL2448267 1.00 GSR (0.41) GSRRNPEPFOLH1CYP2D6NFKB1
SCHEMBL28335157 0.78 GSR (0.44) GSRRNPEPFOLH1CYP2D6NFKB1
SCHEMBL29198588 0.77 FOLH1 (0.41) GSRRNPEPFOLH1CYP2D6NFKB1
SCHEMBL451173 0.75 GSR (0.39) GSRRNPEPFOLH1CYP2D6NFKB1
SCHEMBL19100559 0.75 GSR (0.39) GSRRNPEPFOLH1CYP2D6NFKB1
SCHEMBL451174 0.75 GSR (0.39) GSRRNPEPFOLH1CYP2D6NFKB1
SCHEMBL43620 0.74 FOLH1 (0.57) GSRRNPEPFOLH1CYP2D6NFKB1
SCHEMBL50111 0.74 FOLH1 (0.57) GSRRNPEPFOLH1CYP2D6NFKB1
SCHEMBL1328597 0.73 SIRT6 (0.44) GSRRNPEPFOLH1CPB2GNAI3
SCHEMBL380767 0.73 FOLH1 (0.56) GSRRNPEPFOLH1CYP2D6NFKB1

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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9932687-B2 High throughput screening of crystallization of materials CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2018-04-03 US disclosed
US-20160184824-A1 HIGH THROUGHPUT SCREENING OF CRYSTALLIZATION OF MATERIALS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-06-30 US disclosed
US-9205423-B2 High throughput screening of crystallization of materials CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2015-12-08 US disclosed
US-8709153-B2 Microfludic protein crystallography techniques CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2014-04-29 US disclosed
US-20140041727-A1 HIGH THROUGHPUT SCREENING OF CRYSTALLIZATION OF MATERIALS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-02-13 US disclosed
US-8518883-B2 Method of reducing deleterious effects of ischemia by administration of a thrombopoietin receptor ligand MCW RESEARCH FOUNDATION, INC. (US) 2013-08-27 US disclosed
EP-1392484-B1 HIGH THROUGHPUT SCREENING OF CRYSTALIZATION OF MATERIALS CALIFORNIA INST OF TECHN (US) 2013-06-12 EP disclosed
US-8382896-B2 High throughput screening of crystallization materials CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2013-02-26 US disclosed
US-20120241015-A1 Microfluidic Protein Crystallography Techniques NATIONAL INSTITUTES OF HEALTH 2012-09-27 US disclosed
US-20110306522-A1 MICROFLUIDIC PROTEIN CRYSTALLOGRAPHY CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2011-12-15 US disclosed
US-20050062196-A1 Microfluidic protein crystallography techniques CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2005-03-24 US disclosed
US-20050019794-A1 Crystal growth devices and systems, and methods for using same FLUIDIGM CORPORATION (US) 2005-01-27 US disclosed
WO-2004104228-A1 MICROFLUIDIC PROTEIN CRYSTALLOGRAPHY CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2004-12-02 WO disclosed
WO-2004094020-A2 CRYSTAL GROWTH DEVICES AND SYSTEMS, AND METHODS FOR USING SAME FLUIDIGM CORPORATION (US) 2004-11-04 WO disclosed
US-20040198663-A1 Method of treating cardiac ischemia by using erythropoietin POIETIS, LLC 2004-10-07 US disclosed
EP-1392484-A4 HIGH THROUGHPUT SCREENING OF CRYSTALIZATION OF MATERIALS CALIFORNIA INST OF TECHN (US) 2004-07-28 EP disclosed
US-20040115731-A1 Microfluidic protein crystallography CALIFORNIA INSTITUTE OF TECHNOLOGY 2004-06-17 US disclosed
EP-1392484-A2 HIGH THROUGHPUT SCREENING OF CRYSTALIZATION OF MATERIALS California Institute of Technology (US) 2004-03-03 EP disclosed
US-20030061687-A1 High throughput screening of crystallization materials CALIFORNIA INSTITUTE OF TECHNOLOGY, A CALIFORNIA CORPORATION 2003-04-03 US disclosed
WO-2002082047-A2 HIGH THROUGHPUT SCREENING OF CRYSTALLIZATION OF MATERIALS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2002-10-17 WO disclosed