SCHEMBL13469571

SCHEMBL13469571

CC(C)COC(=O)[C@H](C)NP(=O)(Cl)Oc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 11/20 0.47
ANPEP P15144 1/20 0.45
LAP3 P28838 1/20 0.45
ALDH1A1 P00352 2/20 0.42
TSHR P16473 1/20 0.42
ELANE P08246 2/20 0.41
PRTN3 P24158 1/20 0.39
HPGD P15428 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 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
SCHEMBL523917 0.88 BTN3A1 (0.45) BTN3A1ANPEPLAP3ELANEPRTN3
SCHEMBL523916 0.88 BTN3A1 (0.45) BTN3A1ANPEPLAP3ELANEPRTN3
SCHEMBL807682 0.88 BTN3A1 (0.57) BTN3A1ANPEPLAP3ALDH1A1TSHR
SCHEMBL21158533 0.88 BTN3A1 (0.57) BTN3A1ANPEPLAP3ALDH1A1TSHR
SCHEMBL14466574 0.88 BTN3A1 (0.57) BTN3A1ANPEPLAP3ALDH1A1TSHR
SCHEMBL23992573 0.88 BTN3A1 (0.57) BTN3A1ANPEPLAP3ALDH1A1TSHR
SCHEMBL12900849 0.86 BTN3A1 (0.43) BTN3A1ANPEPLAP3ALDH1A1ELANE
SCHEMBL25387275 0.86 BTN3A1 (0.53) BTN3A1ANPEPLAP3ELANEMEN1
SCHEMBL23992574 0.86 BTN3A1 (0.53) BTN3A1ANPEPLAP3ELANEMEN1
SCHEMBL800889 0.86 BTN3A1 (0.53) BTN3A1ANPEPLAP3ELANEMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112513061-B 4' -Thio-nucleotides and-nucleoside prodrugs for treating cancer 南方研究院 2025-01-24 CN disclosed
EP-4209498-A1 4'-THIO-NUCLEOTIDE AND -NUCLEOSIDE PRODRUGS FOR THE TREATMENT OF CANCER Southern Research Institute (US) 2023-07-12 EP disclosed
EP-4209498-A1 4'-THIO-NUCLEOTIDE AND -NUCLEOSIDE PRODRUGS FOR THE TREATMENT OF CANCER Southern Research Institute (US) 2023-07-12 EP disclosed
US-20230167151-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF JANSSEN PHARMACEUTICA NV (BE) 2023-06-01 US disclosed
WO-2019204637-A1 4'-THIO-NUCLEOTIDE AND -NUCLEOSIDE PRODRUGS FOR THE TREATMENT OF CANCER SOUTHERN RESEARCH INSTITUTE (US) 2019-10-24 WO disclosed
US-20180079774-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF ALIOS BIOPHARMA, INC. 2018-03-22 US disclosed
US-20180044369-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Biopharma, Inc. 2018-02-15 US disclosed
US-9862743-B2 Substituted nucleosides, nucleotides and analogs thereof ALIOS BIOPHARMA, INC. (US) 2018-01-09 US disclosed
US-9815864-B2 Substituted nucleosides, nucleotides and analogs thereof ALIOS BIOPHARMA, INC. (US) 2017-11-14 US disclosed
EP-2696679-B1 2'-CYANO SUBSTITUTED NUCLEOSIDE DERIVATIVES AND METHODS OF USE THEREOF FOR THE TREATMENT OF VIRAL DISEASES MERCK SHARP & DOHME (US) 2017-08-02 EP disclosed
US-20140179627-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF ALIOS BIOPHARMA, INC. (US) 2014-06-26 US disclosed
US-20140179910-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF ALIOS BIOPHARMA, INC. (US) 2014-06-26 US disclosed
US-20140161770-A1 2'-CYANO SUBSTITUTED NUCLEOSIDE DERIVATIVES AND METHODS OF USE THEREOF USEFUL FOR THE TREATMENT OF VIRAL DISEASES MERCK SHARP & DOHME CORP. (US) 2014-06-12 US disclosed
US-20140161770-A1 2'-CYANO SUBSTITUTED NUCLEOSIDE DERIVATIVES AND METHODS OF USE THEREOF USEFUL FOR THE TREATMENT OF VIRAL DISEASES MERCK SHARP & DOHME CORP. (US) 2014-06-12 US disclosed
US-20140066398-A1 HCV POLYMERASE INHIBITORS MEDIVIR, AB (SE) 2014-03-06 US disclosed
US-20140066398-A1 HCV POLYMERASE INHIBITORS MEDIVIR, AB (SE) 2014-03-06 US disclosed
WO-2013084165-A1 HCV POLYMERASE INHIBITORS MEDIVIR AB (SE) 2013-06-13 WO disclosed
US-20130143835-A1 HCV Polymerase Inhibitors MEDIVIR AB (SE) 2013-06-06 US disclosed
US-20130143835-A1 HCV Polymerase Inhibitors MEDIVIR AB (SE) 2013-06-06 US disclosed
WO-2012142093-A2 2'-CYANO SUBSTITUTED NUCLEOSIDE DERIVATIVES AND METHODS OF USE THEREOF FOR THE TREATMENT OF VIRAL DISEASES MERCK SHARP & DOHME CORP. (US) 2012-10-18 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 (8 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-20140179910-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C2 BTN3A1 4056/4885ANPEP 361/4885LAP3 2159/4885
US-20140179627-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C2 BTN3A1 4056/4885ANPEP 361/4885LAP3 2159/4885
US-20140161770-A1 2'-CYANO SUBSTITUTED NUCLEOSIDE DERIVATIVES AND METHODS OF USE THEREOF USEFUL FOR THE TREATMENT OF VIRAL DISEASES HCCS, NSUN2, PNP BTN3A1 2370/4885ANPEP 424/4885LAP3 2661/4885
US-20230167151-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C2 BTN3A1 4056/4885ANPEP 361/4885LAP3 2159/4885
US-20180079774-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C3B BTN3A1 1701/4885ANPEP 227/4885LAP3 1954/4885
US-20180044369-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NT5C3B, NUDT1 BTN3A1 2837/4885ANPEP 244/4885LAP3 2080/4885
US-20130143835-A1 HCV Polymerase Inhibitors POLI, HAVCR2, EIF2AK2 BTN3A1 3624/4885ANPEP 202/4885LAP3 619/4885
US-20140066398-A1 HCV POLYMERASE INHIBITORS POLI, HAVCR2, EIF2AK2 BTN3A1 3624/4885ANPEP 202/4885LAP3 619/4885

“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.