SCHEMBL42314

SCHEMBL42314

Nc1nc2ncnc(N)c2[nH]1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.66
ADORA1 P30542 1/20 0.66
NUDT1 P36639 2/20 0.59
PI4KA P42356 8/20 0.56
PI4K2B Q8TCG2 8/20 0.56
PI4K2A Q9BTU6 8/20 0.56
PI4KB Q9UBF8 8/20 0.56
LMNA P02545 3/20 0.50
TSHR P16473 1/20 0.50
DRD3 P35462 1/20 0.50
XDH P47989 1/20 0.50
LRRK2 Q5S007 1/20 0.50
ERBB2 P04626 1/20 0.47
HSP90AA1 P07900 1/20 0.47
HSP90AB1 P08238 1/20 0.47
APEX1 P27695 1/20 0.46
ALDH1A1 P00352 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ERAP1 Q9NZ08 1/20 0.45

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
SCHEMBL29400753 1.00 ADORA2A (0.66) ADORA2AADORA1NUDT1PI4KAPI4K2B
SCHEMBL30109321 0.81 NUDT1 (0.68) ADORA2AADORA1NUDT1PI4KAPI4K2B
SCHEMBL1059581 0.81 NUDT1 (0.68) ADORA2AADORA1NUDT1PI4KAPI4K2B
SCHEMBL887194 0.80 ADORA2A (0.58) ADORA2AADORA1NUDT1PI4KAPI4K2B
SCHEMBL320848 0.79 NUDT1 (0.43) ADORA2AADORA1NUDT1PI4KAPI4K2B
SCHEMBL1868817 0.79 ADORA2A (0.43) ADORA2AADORA1NUDT1PI4KAPI4K2B
SCHEMBL8566 0.79 ADORA2A (1.00) ADORA2AADORA1NUDT1PI4KAPI4K2B
SCHEMBL5667619 0.79 ADORA2A (0.43) ADORA2AADORA1NUDT1PI4KAPI4K2B
SCHEMBL6826187 0.79 NUDT1 (0.44) ADORA2AADORA1NUDT1PI4KAPI4K2B
SCHEMBL6829681 0.79 ADORA2A (0.43) ADORA2AADORA1NUDT1PI4KAPI4K2B

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

Appears in 3441 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12630827-B2 Antisense oligonucleotides targeting SCN2A for the treatment of SCN1A encephalopathies ROGCON, INC. (US) 2026-05-19 US claimed
US-20250257360-A1 OLIGONUCLEOTIDE INTERFERENCE TREATMENTS OF PROSTATE CANCER UNIV OKLAHOMA (US) 2025-08-14 US claimed
US-20250179503-A1 METHODS OF USING OLIGOMERIC COMPOUNDS TO TREAT SCN2A-RELATED DISORDERS PRAXIS PREC MEDICINES INC (US) 2025-06-05 US claimed
US-20250146073-A1 METHODS FOR THE TREATMENT OF SCN2A-RELATED DISORDERS PRAXIS PREC MEDICINES INC (US) 2025-05-08 US claimed
US-20250122487-A1 ENGINEERED ACETATE KINASE VARIANTS CODEXIS, INC. 2025-04-17 US claimed
EP-4504945-A2 OLIGONUCLEOTIDE INTERFERENCE TREATMENTS OF PROSTATE CANCER The Board of Regents of the University of Oklahoma (US) 2025-02-12 EP claimed
EP-4499835-A2 METHODS OF USING OLIGOMERIC COMPOUNDS TO TREAT SCN2A-RELATED DISORDERS Praxis Precision Medicines, Inc. (US) 2025-02-05 EP claimed
US-12215343-B2 Methods and compositions for RNA-directed target DNA modification and for RNA-directed modulation of transcription THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-02-04 US claimed
EP-4473113-A2 METHODS FOR THE TREATMENT OF SCN2A-RELATED DISORDERS Praxis Precision Medicines, Inc. (US) 2024-12-11 EP claimed
US-12146139-B2 Oligonucleotide interference treatments of prostate cancer THE BOARD OF REGENTS OF THE UNIVERSITY OF OKLAHOMA (US) 2024-11-19 US claimed
US-6566514-B1 Antisense oligonucleotides for use in the treatment of tumors GENESENSE TECHNOLOGIES INC. (CA) 2003-05-20 US claimed
EP-1228243-A1 COMPOSITIONS AND METHODS OF SYNTHESIS AND USE OF NOVEL NUCLEIC ACID STRUCTURES Cygene, Inc. (US) 2002-08-07 EP claimed
US-6369237-B1 ENZYME INHIBITORS OF DNA GLYCOLASE PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2002-04-09 US claimed
WO-2001032924-A1 COMPOSITIONS AND METHODS OF SYNTHESIS AND USE OF NOVEL NUCLEIC ACID STRUCTURES CYGENE, INC. (US) 2001-05-10 WO claimed
EP-0898575-A2 A COMBINATORIAL PROTECTING GROUP STRATEGY FOR MULTIFUNCTIONAL MOLECULES KÖSTER, Hubert (US) 1999-03-03 EP claimed
WO-1998039334-A9 DNA GLYCOSYLASE INHIBITORS, AND USES RELATED THERETO 1999-02-18 WO claimed
US-5872243-A Caged nucleotides MOLECULAR PROBES, INC. (US) 1999-02-16 US claimed
WO-1998039334-A1 DNA GLYCOSYLASE INHIBITORS, AND USES RELATED THERETO PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1998-09-11 WO claimed
WO-1997041139-A2 A COMBINATORIAL PROTECTING GROUP STRATEGY FOR MULTIFUNCTIONAL MOLECULES KOESTER HUBERT (US) 1997-11-06 WO claimed
US-5118800-A Oligonucleotides possessing a primary amino group in the terminal nucleotide CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 1992-06-02 US claimed