SCHEMBL42313

SCHEMBL42313

Nc1nc2c(N)ncnc2[nH]1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.42
ADORA1 P30542 2/20 0.42
ERAP1 Q9NZ08 1/20 0.42
PI4KA P42356 7/20 0.39
PI4K2B Q8TCG2 7/20 0.39
PI4K2A Q9BTU6 7/20 0.39
PI4KB Q9UBF8 7/20 0.39
NUDT1 P36639 2/20 0.39
XDH P47989 3/20 0.38
LRRK2 Q5S007 2/20 0.38
LMNA P02545 2/20 0.38
RET P07949 1/20 0.38
DRD3 P35462 1/20 0.38
ALDH1A1 P00352 2/20 0.37
USP2 O75604 1/20 0.37
TP53 P04637 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
HPGD P15428 1/20 0.37
PTGS1 P23219 1/20 0.37
MAPK3 P27361 1/20 0.37

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
SCHEMBL842439 0.78 ADORA2A (0.40) ADORA2AADORA1ERAP1PI4KAPI4K2B
SCHEMBL160304 0.78 ADORA2A (0.40) ADORA2AADORA1ERAP1PI4KAPI4K2B
SCHEMBL6829678 0.78 ALDH1A1 (0.35) ADORA2AADORA1ERAP1NUDT1XDH
SCHEMBL953009 0.78 NUDT1 (0.41) ADORA2AADORA1ERAP1PI4KAPI4K2B
SCHEMBL4581404 0.78 PI4KA (0.41) ADORA2AADORA1ERAP1PI4KAPI4K2B
SCHEMBL6826186 0.78 ALDH1A1 (0.35) ADORA2AADORA1ERAP1NUDT1XDH
SCHEMBL12489702 0.78 CHEK1 (0.36) ADORA2AADORA1NUDT1XDHLMNA
SCHEMBL11125305 0.78 ALDH1A1 (0.35) ADORA2AADORA1ERAP1NUDT1XDH
SCHEMBL12620888 0.78 ADORA2A (0.40) ADORA2AADORA1ERAP1PI4KAPI4K2B
SCHEMBL159639 0.78 ADORA2A (0.40) ADORA2AADORA1ERAP1PI4KAPI4K2B

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 3482 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
WO-2001032924-A1 COMPOSITIONS AND METHODS OF SYNTHESIS AND USE OF NOVEL NUCLEIC ACID STRUCTURES CYGENE, INC. (US) 2001-05-10 WO claimed
CN-1230184-A Arylamino fused pyridines and pyrimidines DU PONT MERCK PHARMA (US) 1999-09-29 CN 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
EP-0672171-A1 FORMATION OF TRIPLE HELIX COMPLEXES OF DOUBLE STRANDED DNA USING NUCLEOSIDE OLIGOMERS WHICH COMPRISE PURINE BASE ANALOGS THE JOHNS HOPKINS UNIVERSITY (US) 1995-09-20 EP claimed
WO-1993005180-A1 FORMATION OF TRIPLE HELIX COMPLEXES OF DOUBLE STRANDED DNA USING NUCLEOSIDE OLIGOMERS WHICH COMPRISE PURINE BASE ANALOGS THE JOHNS HOPKINS UNIVERSITY (US) 1993-03-18 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