SCHEMBL385550

SCHEMBL385550

CC(OCP(=O)(O)O)n1cnc2c(Cl)nc(N)nc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.45
HPRT1 P00492 1/20 0.43
CDK1 P06493 3/20 0.43
CDK2 P24941 3/20 0.43
CCNB1 P14635 2/20 0.43
CCNE1 P24864 2/20 0.43
NT5E P21589 1/20 0.42
HSP90AB1 P08238 11/20 0.41
HSP90AA1 P07900 10/20 0.41
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
PRKACA P17612 1/20 0.38
CCNA2 P20248 1/20 0.38
PRKACG P22612 1/20 0.38
PRKACB P22694 1/20 0.38
MAPK3 P27361 1/20 0.38
MAPK1 P28482 1/20 0.38
CCNA1 P78396 1/20 0.38
HSP90B1 P14625 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
SCHEMBL17601915 0.86 CYP3A4 (0.43) CYP3A4HPRT1CDK1CDK2CCNB1
SCHEMBL6902158 0.81 CYP3A4 (0.65) CYP3A4HPRT1HSP90AB1HSP90AA1HDAC4
SCHEMBL6902140 0.81 CYP3A4 (0.65) CYP3A4HPRT1HSP90AB1HSP90AA1HDAC4
SCHEMBL3852462 0.79 CYP3A4 (0.46) CYP3A4HSP90AB1HSP90AA1HDAC4HDAC1
SCHEMBL3855208 0.79 CYP3A4 (0.46) CYP3A4HSP90AB1HSP90AA1HDAC4HDAC1
SCHEMBL3852447 0.79 CYP3A4 (0.46) CYP3A4HSP90AB1HSP90AA1HDAC4HDAC1
SCHEMBL886938 0.78 CYP3A4 (0.67) CYP3A4
SCHEMBL17599288 0.78 HPRT1 (0.38) CYP3A4HPRT1CDK1CDK2CCNB1
SCHEMBL13742912 0.77 HPRT1 (0.44) HPRT1CDK1CDK2CCNB1CCNE1
SCHEMBL31058756 0.76 CDK1 (0.54) CDK1CDK2CCNB1CCNE1HSP90AB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11572377-B2 Nucleotide analogs THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-02-07 US disclosed
US-20220395510-A1 Nucleotide Analogs THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF VETERANS AFFAIRS, OFFICE OF THE GENERAL COUNSEL (024) 2022-12-15 US disclosed
US-11344555-B2 Nucleotide analogs THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-05-31 US disclosed
EP-3194411-B1 NUCLEOTIDE ANALOGS UNIV CALIFORNIA (US) 2022-05-04 EP disclosed
US-20220072004-A1 Nucleotide Analogs THE UNITED STATES GOVERNMENT AS REPRESENTED BY THE DEPARTMENT OF VETERANS AFFAIRS 2022-03-10 US disclosed
EP-3350191-B9 NUCLEOTIDE ANALOGS UNIV CALIFORNIA (US) 2021-12-22 EP disclosed
EP-3875462-A1 NUCLEOTIDE ANALOGS The Regents of The University of California (US) 2021-09-08 EP disclosed
US-20210246153-A1 Nucleotide Analogs THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-08-12 US disclosed
US-11014950-B2 Nucleotide analogs THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-05-25 US disclosed
EP-3350191-B1 NUCLEOTIDE ANALOGS UNIV CALIFORNIA (US) 2021-05-12 EP disclosed
WO-2017048956-A1 NUCLEOTIDE ANALOGS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-03-23 WO disclosed
US-20170037068-A1 NUCLEOTIDE ANALOGS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-02-09 US disclosed
US-9493493-B2 Nucleotide analogs THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-11-15 US disclosed
WO-2016044281-A1 NUCLEOTIDE ANALOGS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-03-24 WO disclosed
US-20160083407-A1 NUCLEOTIDE ANALOGS THE UNITED STATES GOVERNMENT AS REPRESENTED BY THE DEPARTMENT OF VETERANS AFFAIRS 2016-03-24 US disclosed
EP-1831235-B1 LUNG-TARGETED DRUGS UNIV CALIFORNIA (US) 2013-02-20 EP disclosed
US-8101745-B2 Conjugate cidofovir, idoxuridine, vidarabine, trifluridine, acyclovir, famciclovir penciclovir, valacyclovir, ganciclovir, antiviral, antimicrobial, cancer drug of interest to glycerol ethers or glycerol phosphate ethers THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-01-24 US disclosed
US-20080221061-A1 Lung-Targeted Drugs THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2008-09-11 US disclosed
EP-1831235-A2 LUNG-TARGETED DRUGS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-09-12 EP disclosed
WO-2006066074-A2 LUNG-TARGETED DRUGS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2006-06-22 WO 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 (9 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-11572377-B2 Nucleotide analogs NUDT1, DUT, DPYD CYP3A4 3875/4885HPRT1 52/4885CDK1 1675/4885
US-20080221061-A1 Lung-Targeted Drugs DGKG, GK, PHOSPHO1 CYP3A4 3814/4885HPRT1 3277/4885CDK1 1683/4885
US-11014950-B2 Nucleotide analogs NUDT1, DUT, DPYD CYP3A4 3875/4885HPRT1 52/4885CDK1 1675/4885
US-20220395510-A1 Nucleotide Analogs NUDT1, DUT, DPYD CYP3A4 3875/4885HPRT1 52/4885CDK1 1675/4885
US-20220072004-A1 Nucleotide Analogs NUDT1, DUT, DPYD CYP3A4 3875/4885HPRT1 52/4885CDK1 1675/4885
US-20160083407-A1 NUCLEOTIDE ANALOGS NUDT1, DUT, DPYD CYP3A4 3875/4885HPRT1 52/4885CDK1 1675/4885
US-11344555-B2 Nucleotide analogs NUDT1, DUT, DPYD CYP3A4 3875/4885HPRT1 52/4885CDK1 1675/4885
US-20170037068-A1 NUCLEOTIDE ANALOGS NUDT1, DUT, DPYD CYP3A4 3875/4885HPRT1 52/4885CDK1 1675/4885
US-20210246153-A1 Nucleotide Analogs NUDT1, DUT, DPYD CYP3A4 3875/4885HPRT1 52/4885CDK1 1675/4885

“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.