SCHEMBL546736

SCHEMBL546736

CSc1nc(NCCC(C)C)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 2/20 0.60
PGK2 P07205 2/20 0.60
KDM4E B2RXH2 1/20 0.56
PKM P14618 1/20 0.56
ADORA3 P0DMS8 1/20 0.55
ADORA1 P30542 1/20 0.55
ADORA2A P29274 2/20 0.54
ADORA2B P29275 2/20 0.54
SLC29A1 Q99808 1/20 0.54

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
SCHEMBL546737 1.00 PGK1 (0.60) PGK1PGK2KDM4EPKMADORA3
SCHEMBL29389303 0.87 PGK1 (0.60) PGK1PGK2KDM4EPKMADORA3
SCHEMBL40851 0.87 PGK1 (0.60) PGK1PGK2KDM4EPKMADORA3
SCHEMBL28120773 0.85 KDM4E (0.64) PGK1PGK2KDM4EPKMADORA3
SCHEMBL1961097 0.85 ADORA3 (0.74) KDM4EPKMADORA3ADORA1ADORA2A
SCHEMBL3692106 0.85 ADORA3 (0.74) KDM4EPKMADORA3ADORA1ADORA2A
SCHEMBL24920319 0.84 KDM4E (0.56) PGK1PGK2KDM4EPKMADORA3
SCHEMBL30208467 0.84 KDM4E (0.56) PGK1PGK2KDM4EPKMADORA3
SCHEMBL30208578 0.84 KDM4E (0.56) PGK1PGK2KDM4EPKMADORA3
SCHEMBL18171845 0.84 KDM4E (0.57) PGK1PGK2KDM4EPKMADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3827390-B1 SYSTEMS AND METHODS FOR SUPPORTING MULTIPLE AUTOMATED WORKFLOWS LIFEFOUNDRY INC (US) 2026-05-20 EP disclosed
EP-3571582-B1 SYSTEMS AND METHODS FOR SUPPORTING MULTIPLE AUTOMATED WORKFLOWS LIFEFOUNDRY INC (US) 2026-02-11 EP disclosed
EP-4640248-A1 DRY FORMULATION FOR TISSUE REPAIR Samyang Holdings Corporation (KR) 2025-10-29 EP disclosed
US-12399479-B2 Systems and methods for supporting multiple automated workflows LifeFoundry Inc. (US) 2025-08-26 US disclosed
US-12338485-B2 Multiplexed profiling of RNA and DNA modifications Alida Biosciences Inc. (US) 2025-06-24 US disclosed
CN-113151407-B Revealing modified nucleotide and nucleic acid interactions in single cells 西格马-奥尔德里奇有限责任公司 2025-03-25 CN disclosed
CN-112823365-B System and method for supporting multiple automated workflows 衍进科技公司 2025-03-11 CN disclosed
US-20250044769-A1 SYSTEMS AND METHODS FOR SUPPORTING MULTIPLE AUTOMATED WORKFLOWS LifeFoundry Inc. 2025-02-06 US disclosed
US-20250004439-A1 SYSTEMS AND METHODS FOR SUPPORTING MULTIPLE AUTOMATED WORKFLOWS LifeFoundry Inc. 2025-01-02 US disclosed
US-12117792-B2 Systems and methods for supporting multiple automated workflows LifeFoundry Inc. (US) 2024-10-15 US disclosed
US-7566555-B2 Method of expressing proteins comprising non-naturally-occurring amino acids RIKEN (JP) 2009-07-28 US disclosed
EP-1557469-B1 METHOD OF EXPRESSING PROTEIN HAVING UNNATURAL AMINO ACID INTEGRATED THEREINTO RIKEN (JP) 2007-12-19 EP disclosed
US-20060234339-A1 Method of expressing protein having unnatural amino acid integrated thereinto RIKEN (JP) 2006-10-19 US disclosed
EP-1377682-A4 METHODS FOR THE SYNTHESIS OF POLYNUCLEOTIDES AND COMBINATORIAL LIBRARIES OF POLYNUCLEOTIDES HERCULES INC (US) 2005-05-25 EP disclosed
EP-1383910-A2 METHODS FOR THE PREPARATION OF POLYNUCLEOTIDE LIBRAIRIES AND IDENTIFICATION OF LIBRARY MEMBERS HAVING DESIRED CHARACTERISTICS HERCULES INCORPORATED (US) 2004-01-28 EP disclosed
EP-1377682-A1 METHODS FOR THE SYNTHESIS OF POLYNUCLEOTIDES AND COMBINATORIAL LIBRARIES OF POLYNUCLEOTIDES HERCULES INCORPORATED (US) 2004-01-07 EP disclosed
US-20030087254-A1 Methods for the preparation of polynucleotide libraries and identification of library members having desired characteristics HERCULES INCORPORATED 2003-05-08 US disclosed
US-20030049619-A1 Methods for the synthesis of polynucleotides and combinatorial libraries of polynucleotides HERCULES INCORPORATED 2003-03-13 US disclosed
WO-2002081643-A2 METHODS FOR THE PREPARATION OF POLYNUCLEOTIDE LIBRAIRIES AND IDENTIFICATION OF LIBRARY MEMBERS HAVING DESIRED CHARACTERISTICS HERCULES INCORPORATED (US) 2002-10-17 WO disclosed
WO-2002077289-A1 METHODS FOR THE SYNTHESIS OF POLYNUCLEOTIDES AND COMBINATORIAL LIBRARIES OF POLYNUCLEOTIDES HERCULES INCORPORATED (US) 2002-10-03 WO disclosed