SCHEMBL9910656

SCHEMBL9910656

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

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
XDH P47989 3/20 0.42
TK1 P04183 1/20 0.41
KMT2A Q03164 1/20 0.41
CDK1 P06493 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPK1 P28482 1/20 0.41
PMP22 Q01453 1/20 0.41
YTHDC1 Q96MU7 1/20 0.39
ADORA3 P0DMS8 3/20 0.39
HPRT1 P00492 2/20 0.39
GDA Q9Y2T3 1/20 0.39
PNP P00491 1/20 0.38
RAB9A P51151 1/20 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
SCHEMBL3427614 0.81 CDK1 (0.47) XDHTK1KMT2ACDK1CYP3A4
SCHEMBL21362203 0.81 XDH (0.41) XDHTK1KMT2ACYP3A4ADORA3
9-Methylguanine SCHEMBL22884 0.81 XDH (0.58) XDHTK1KMT2AHPRT1PNP
SCHEMBL18521149 0.81 CDK1 (0.40) XDHTK1KMT2ACDK1CYP3A4
SCHEMBL12702573 0.78 PI4KA (0.41) XDHTK1KMT2AADORA3PNP
SCHEMBL20655295 0.78 XDH (0.40) XDHTK1KMT2AADORA3HPRT1
SCHEMBL754057 0.78 CDK2 (0.47) XDHKMT2ACDK1HPRT1
SCHEMBL25100647 0.78 CDK1 (0.38) XDHTK1CDK1CYP3A4MAPK1
SCHEMBL10037062 0.78 YTHDC1 (0.46) TK1KMT2ACDK1CYP3A4MAPK1
SCHEMBL17898192 0.78 CDK1 (0.38) XDHTK1CDK1CYP3A4MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240066047-A1 ANTIBODY-DRUG CONJUGATES COMPRISING A CYCLIC DINUCLEOTIDE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-02-29 US disclosed
US-20230257414-A1 NUCLEOTIDE ANALOGUES FIRST-CITIZENS BANK & TRUST COMPANY 2023-08-17 US disclosed
EP-3765474-B1 CYCLOPENTANE-BASED MODULATORS OF STING (STIMULATOR OF INTERFERON GENES) PFIZER (US) 2022-06-15 EP disclosed
WO-2019175776-A1 CYCLOPENTANE-BASED MODULATORS OF STING (STIMULATOR OF INTERFERON GENES) PFIZER INC. (US) 2019-09-19 WO disclosed
US-20180065965-A1 SULFAMIDE AND SULFAMATE INHIBITORS OF hHint1 REGENTS OF THE UNIVERSITY OF MINNESOTA 2018-03-08 US disclosed
US-20170369876-A1 EXON SKIPPING COMPOSITIONS FOR TREATING MUSCULAR DYSTROPHY SAREPTA THERAPEUTICS, INC. 2017-12-28 US disclosed
US-20170340633-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION 2017-11-30 US disclosed
US-9708357-B2 4′-azido, 3′-fluoro substituted nucleoside derivatives as inhibitors of HCV RNA replication Riboscience, LLC (US) 2017-07-18 US disclosed
US-9700560-B2 2′-fluoro-6′-methylene carbocyclic nucleosides and methods of treating viral infections UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2017-07-11 US disclosed
US-9487772-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2016-11-08 US disclosed
US-20120172591-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION (US) 2012-07-05 US disclosed
US-8193165-B2 Anti-viral nucleoside analogs and methods for treating viral infections, especially HIV infections YALE UNIVERSITY (US) 2012-06-05 US disclosed
US-8138195-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2012-03-20 US disclosed
US-8076461-B2 antibody microarray for detecting incomplete deprotection of synthetic test oligonucleotides; high throughput assay; solid phase synthesis PROTEOME SCIENCES PLC (GB) 2011-12-13 US disclosed
US-20110092574-A1 mRNA Cap Analogs NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2011-04-21 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-20100048500-A1 Anti-viral nucleoside analogs and methods for treating viral infections, especially HIV infections NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-02-25 US disclosed
US-7589078-B2 Using a dideoxy and didehydro nucleoside YALE UNIVERSITY (US) 2009-09-15 US disclosed
US-20070179100-A1 Protected monomers ALNYLAM PHARMACEUTICALS, INC. 2007-08-02 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 (11 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 XDH 1435/4885TK1 216/4885KMT2A 2385/4885
US-20100152211-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG XDH 4334/4885TK1 536/4885KMT2A 3249/4885
US-20170340633-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG XDH 4334/4885TK1 536/4885KMT2A 3249/4885
US-20100168139-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG XDH 4334/4885TK1 536/4885KMT2A 3249/4885
US-20100048500-A1 Anti-viral nucleoside analogs and methods for treating viral infections, especially HIV infections TYMP, ITPA, SAMHD1 XDH 169/4885TK1 91/4885KMT2A 1891/4885
US-20120172591-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG XDH 4334/4885TK1 536/4885KMT2A 3249/4885
US-20170369876-A1 EXON SKIPPING COMPOSITIONS FOR TREATING MUSCULAR DYSTROPHY RBM17, MBNL1, UTRN XDH 4765/4885TK1 2630/4885KMT2A 3575/4885
US-20180065965-A1 SULFAMIDE AND SULFAMATE INHIBITORS OF hHint1 GRIN1, GRIA1, GRIN2A XDH 1609/4885TK1 2245/4885KMT2A 367/4885
US-20230257414-A1 NUCLEOTIDE ANALOGUES ITPA, POLB, NUDT1 XDH 1174/4885TK1 98/4885KMT2A 1334/4885
US-20110092574-A1 mRNA Cap Analogs RNMT, RNGTT, NSUN2 XDH 4634/4885TK1 2356/4885KMT2A 2408/4885
US-20070179100-A1 Protected monomers PCNA, POLN, PARP1 XDH 2529/4885TK1 1827/4885KMT2A 1569/4885

“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.