SCHEMBL754057

SCHEMBL754057

Cc1nc2c(ncn2C(C)C)c(=O)[nH]1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 7/20 0.47
CDK1 P06493 6/20 0.47
CCNE1 P24864 3/20 0.47
CCNB1 P14635 2/20 0.47
PDE2A O00408 1/20 0.43
ADORA2A P29274 1/20 0.41
ADORA2B P29275 1/20 0.41
ADORA1 P30542 1/20 0.41
PI4KA P42356 1/20 0.41
PI4K2B Q8TCG2 1/20 0.41
PI4K2A Q9BTU6 1/20 0.41
PI4KB Q9UBF8 1/20 0.41
XDH P47989 2/20 0.40
HPRT1 P00492 2/20 0.39
KMT2A Q03164 1/20 0.39
CDK5 Q00535 4/20 0.38
CCNA2 P20248 3/20 0.38
CCNA1 P78396 3/20 0.38
DYRK1A Q13627 3/20 0.38
CDK5R1 Q15078 3/20 0.38

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
SCHEMBL22166090 0.83 HPRT1 (0.44) PDE2AXDHHPRT1KMT2A
SCHEMBL22907592 0.83 CDK2 (0.46) CDK2CDK1CCNE1CCNB1PDE2A
SCHEMBL18521157 0.83 CDK2 (0.46) CDK2CDK1CCNE1CCNB1PDE2A
SCHEMBL2385929 0.83 HPRT1 (0.55) CDK2CDK1CCNE1CCNB1XDH
SCHEMBL18520809 0.83 CDK2 (0.46) CDK2CDK1CCNE1CCNB1PDE2A
SCHEMBL18510386 0.81 CDK2 (0.47) CDK2CDK1CCNE1CCNB1ADORA2A
SCHEMBL17282460 0.80 CDK2 (0.44) CDK2CDK1CCNE1CCNB1PDE2A
SCHEMBL22326763 0.80 PDE2A (0.48) CDK2CDK1CCNE1CCNB1PDE2A
SCHEMBL25469093 0.79 KDM4E (0.43) CDK2CDK1CCNE1CCNB1PDE2A
SCHEMBL9910656 0.78 XDH (0.42) CDK1XDHHPRT1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240240217-A1 NUCLEOSIDES AND NUCLEOTIDES WITH 3' BLOCKING GROUPS AND CLEAVABLE LINKERS ILLUMINA, INC. 2024-07-18 US disclosed
US-12030911-B2 Synthesis and biological activity of phosphoramidimidate and phosphoramidate DNA THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2024-07-09 US disclosed
US-20240209017-A1 STING MODULATOR COMPOUNDS, AND METHODS OF MAKING AND USING TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-06-27 US disclosed
US-20240066047-A1 ANTIBODY-DRUG CONJUGATES COMPRISING A CYCLIC DINUCLEOTIDE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-02-29 US disclosed
US-20230381216-A1 EXON SKIPPING OLIGOMER CONJUGATES FOR MUSCULAR DYSTROPHY SAREPTA THERAPEUTICS, INC. (US) 2023-11-30 US disclosed
US-20230357168-A1 CARBOBICYCLIC NUCLEOSIDES FOR TREATMENT OF VIRAL INFECTION UNIV HONG KONG CHINESE (CN) 2023-11-09 US disclosed
US-20230332197-A1 NUCLEOSIDES AND NUCLEOTIDES WITH 3' VINYL BLOCKING GROUP ILLUMINA, INC. 2023-10-19 US disclosed
US-20230314322-A1 SYSTEMS AND METHODS OF SEQUENCING POLYNUCLEOTIDES ILLUMINA, INC. 2023-10-05 US disclosed
US-11773132-B2 Cyclic di-nucleotides as stimulator of interferon genes modulators BEIJING XUANYI PHARMASCIENCES CO., LTD. (CN) 2023-10-03 US disclosed
US-11773132-B2 Cyclic di-nucleotides as stimulator of interferon genes modulators BEIJING XUANYI PHARMASCIENCES CO., LTD. (CN) 2023-10-03 US disclosed
US-20100168139-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION 2010-07-01 US disclosed
US-20100152211-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION 2010-06-17 US disclosed
US-7666855-B2 2′-C-methyl nucleoside derivatives METABASIS THERAPEUTICS, INC. (US) 2010-02-23 US disclosed
US-20100022620-A1 EPITOPE REDUCTION THERAPY ISIS INNOVATION LIMITED (GB) 2010-01-28 US disclosed
US-20090181921-A1 2-5A ANALOGS AND THEIR METHODS OF USE ALIOS BIOPHARMA INC. (US) 2009-07-16 US disclosed
US-20090176732-A1 PROTECTED NUCLEOTIDE ANALOGS ALIOS BIOPHARMA INC. (US) 2009-07-09 US disclosed
US-20090118223-A1 Novel 2'-c-methyl and 4'c-methyl nucleoside derivatives MERCK SHARP & DOHME CORP. 2009-05-07 US disclosed
US-20080207554-A1 2-5A Analogs and their Methods of Use ALIOS BIOPHARMA, INC. (US) 2008-08-28 US disclosed
US-20070179114-A1 Novel 2'-C methyl nucleoside derivatives METABASIS THERAPEUTICS, INC. (US) 2007-08-02 US disclosed
US-20070042989-A1 Novel 2'-C-methyl nucleoside derivatives METABASIS THERAPEUTICS, INC. (US) 2007-02-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (17 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240066047-A1 ANTIBODY-DRUG CONJUGATES COMPRISING A CYCLIC DINUCLEOTIDE STING1, TLR9, CGAS CDK2 4868/4885CDK1 4739/4885CCNE1 4880/4885
US-12030911-B2 Synthesis and biological activity of phosphoramidimidate and phosphoramidate DNA RNASEH1, RNASE1, DNASE1 CDK2 2420/4885CDK1 2487/4885CCNE1 2001/4885
US-20100152211-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG CDK2 124/4885CDK1 199/4885CCNE1 1040/4885
US-20100168139-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG CDK2 124/4885CDK1 199/4885CCNE1 1040/4885
US-20240240217-A1 NUCLEOSIDES AND NUCLEOTIDES WITH 3' BLOCKING GROUPS AND CLEAVABLE LINKERS NT5C2, DUT, NT5C3B CDK2 505/4885CDK1 300/4885CCNE1 1434/4885
US-20090176732-A1 PROTECTED NUCLEOTIDE ANALOGS NTPCR, NT5C2, PNP CDK2 2475/4885CDK1 3363/4885CCNE1 3751/4885
US-20070042989-A1 Novel 2'-C-methyl nucleoside derivatives NSUN2, NT5C3B, MTAP CDK2 202/4885CDK1 379/4885CCNE1 398/4885
US-20240209017-A1 STING MODULATOR COMPOUNDS, AND METHODS OF MAKING AND USING STING1, CGAS, MAVS CDK2 4649/4885CDK1 3824/4885CCNE1 4804/4885
US-20230332197-A1 NUCLEOSIDES AND NUCLEOTIDES WITH 3' VINYL BLOCKING GROUP NT5C3B, NSUN2, DUT CDK2 614/4885CDK1 727/4885CCNE1 1967/4885
US-20090181921-A1 2-5A ANALOGS AND THEIR METHODS OF USE RNASEL, RNASE1, RNASEH1 CDK2 1508/4885CDK1 2448/4885CCNE1 3168/4885
US-20230357168-A1 CARBOBICYCLIC NUCLEOSIDES FOR TREATMENT OF VIRAL INFECTION PNP, SLC29A1, SLC29A2 CDK2 46/4885CDK1 69/4885CCNE1 310/4885
US-11773132-B2 Cyclic di-nucleotides as stimulator of interferon genes modulators STING1, IRF3, CGAS CDK2 3025/4885CDK1 2787/4885CCNE1 3531/4885
US-20090118223-A1 Novel 2'-c-methyl and 4'c-methyl nucleoside derivatives MTAP, NT5C3B, NSUN2 CDK2 423/4885CDK1 865/4885CCNE1 1498/4885
US-20230381216-A1 EXON SKIPPING OLIGOMER CONJUGATES FOR MUSCULAR DYSTROPHY UTRN, SMN1; SMN2, DCLRE1B CDK2 3777/4885CDK1 3738/4885CCNE1 3210/4885
US-20080207554-A1 2-5A Analogs and their Methods of Use RNASEL, RNASE1, RNASEH1 CDK2 1610/4885CDK1 2630/4885CCNE1 3732/4885
US-20070179114-A1 Novel 2'-C methyl nucleoside derivatives NSUN2, NT5C3B, MTAP CDK2 190/4885CDK1 382/4885CCNE1 392/4885
US-20100022620-A1 EPITOPE REDUCTION THERAPY UGCG, GBA1, ENGASE CDK2 4714/4885CDK1 4739/4885CCNE1 4679/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.