SCHEMBL3103479

SCHEMBL3103479

CCNC(=O)[C@@H](N)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.37
SLC1A3 P43003 2/20 0.35
SLC1A2 P43004 2/20 0.35
SLC1A1 P43005 2/20 0.35
TSHR P16473 2/20 0.34
SLC7A5 Q01650 2/20 0.34
USP2 O75604 1/20 0.34
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
MMP9 P14780 1/20 0.34
MMP8 P22894 1/20 0.34
DPP7 Q9UHL4 2/20 0.34
KMT2A Q03164 2/20 0.33
GRIK1 P39086 1/20 0.33
GRIK2 Q13002 1/20 0.33
MEN1 O00255 1/20 0.33
ACE P12821 1/20 0.32

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
SCHEMBL12303664 0.87 TSHR (0.39) PKMTSHRUSP2MMP1MMP2
SCHEMBL12955470 0.75
SCHEMBL4972791 0.75
SCHEMBL2246459 0.75
SCHEMBL2246463 0.75
SCHEMBL10288542 0.73
Hydrochloric Acid SCHEMBL15792147 0.73
Hydrochloric Acid SCHEMBL22979248 0.73
Diethylamine SCHEMBL28600128 0.73 TP53 (0.40) SLC1A3SLC1A2SLC1A1SLC7A5GRIK1
Hydrochloric Acid SCHEMBL15792149 0.73

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1301519-B2 PRODRUGS OF PHOSPHONATE NUCLEOTIDE ANALOGUES AND METHODS FOR SELECTING AND MAKING SAME GILEAD SCIENCES INC (US) 2021-11-10 EP disclosed
EP-3235823-A1 PRODRUGS OF PHOSPHONATE NUCLEOTIDE ANALOGUES AND METHODS FOR SELECTING AND MAKING SAME Gilead Sciences, Inc. (US) 2017-10-25 EP disclosed
EP-2682397-B1 Prodrugs of phosphonate nucleotide analogues and methods for selecting and making same GILEAD SCIENCES INC (US) 2017-04-19 EP disclosed
EP-1301519-B1 PRODRUGS OF PHOSPHONATE NUCLEOTIDE ANALOGUES AND METHODS FOR SELECTING AND MAKING SAME GILEAD SCIENCES INC (US) 2015-02-25 EP disclosed
EP-2682397-A1 Prodrugs of phosphonate nucleotide analogues and methods for selecting and making same GILEAD SCIENCES, INC. (US) 2014-01-08 EP disclosed
US-7803788-B2 Prodrugs of phosphonate nucoleotide analogues GILEAD SCIENCES, INC. (US) 2010-09-28 US disclosed
US-20080227754-A1 PRODRUGS OF PHOSPHONATE NUCLEOTIDE ANALOGUES GILEAD SCIENCES, INC. 2008-09-18 US disclosed
US-7390791-B2 Which contain phosphoramidate linkages; for retroviral or hepadnaviral therapy; for treatment of HIV/aquired immunodeficiency syndrome; antitumor agents; improved bioavailability GILEAD SCIENCES, INC. (US) 2008-06-24 US disclosed
US-20060024659-A1 Prodrugs of phosphonate nucleotide analogues and methods for selecting and making same GILEAD SCIENCES, INC. 2006-02-02 US disclosed
US-20050159392-A1 Phosphoramidate linkages; retroviral or hepadnaviral therapy; tissue targeted therapy; HIV/aquired immunodeficiency syndrome; antitumor agents; improved bioavailability BECKER MARK W (US) 2005-07-21 US disclosed
US-20050124585-A1 Prodrugs of phosphonate nucleotide analogues BECKER MARK W (US) 2005-06-09 US disclosed
US-20050124584-A1 Prodrugs of phosphonate nucleotide analogues BECKER MARK W (US) 2005-06-09 US disclosed
US-20050124583-A1 Novel mixed ester-amidates of 9-[2-(phosphonomethoxy)ethyl]adenine (PMPA) for retroviral or hepadnaviral target tissue therapy; viricides; antitumor and -carcinogenic agents; HIV; less toxicity to bystander tissues; greater potency of the parental drug; accumulation in lymphatic tissue BECKER MARK W (US) 2005-06-09 US disclosed
US-20050009043-A1 Prodrugs of phosphonate nucleotide analogues GILEAD SCIENCES, INC. 2005-01-13 US disclosed
US-20040018150-A1 Prodrugs of phosphonate nucleotide analogues and methods for selecting and making same BECKER MARK W (US) 2004-01-29 US disclosed
US-20030219727-A1 Prodrugs of phosphonate nucleotide analogues BECKER MARK W (US) 2003-11-27 US disclosed
EP-1301519-A2 PRODRUGS OF PHOSPHONATE NUCLEOTIDE ANALOGUES AND METHODS FOR SELECTING AND MAKING SAME GILEAD SCIENCES, INC. (US) 2003-04-16 EP disclosed
US-20020119443-A1 Prodrugs of phosphonate nucleotide analogues and methods for selecting and making same GILEAD SCIENCES, INC. 2002-08-29 US disclosed
WO-2002008241-A2 PRODRUGS OF PHOSPHONATE NUCLEOTIDE ANALOGUES AND METHODS FOR SELECTING AND MAKING SAME GILEAD SCIENCES, INC. (US) 2002-01-31 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 (7 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-20050124583-A1 Novel mixed ester-amidates of 9-[2-(phosphonomethoxy)ethyl]adenine (PMPA) for retroviral or hepadnaviral target tissue therapy; viricides; antitumor and -carcinogenic agents; HIV; less toxicity to bystander tissues; greater potency of the parental drug; accumulation in lymphatic tissue PNP, PHOSPHO1, ENTPD1 PKM 894/4885SLC1A3 2482/4885SLC1A2 3069/4885
US-20050009043-A1 Prodrugs of phosphonate nucleotide analogues PNP, TYMP, APRT PKM 1050/4885SLC1A3 1257/4885SLC1A2 1895/4885
US-20050159392-A1 Phosphoramidate linkages; retroviral or hepadnaviral therapy; tissue targeted therapy; HIV/aquired immunodeficiency syndrome; antitumor agents; improved bioavailability SLC25A17, SLC25A1, SLC25A21 PKM 1009/4885SLC1A3 807/4885SLC1A2 1772/4885
US-20050124584-A1 Prodrugs of phosphonate nucleotide analogues PNP, TYMP, APRT PKM 1050/4885SLC1A3 1257/4885SLC1A2 1895/4885
US-20040018150-A1 Prodrugs of phosphonate nucleotide analogues and methods for selecting and making same PNP, PNPO, MTAP PKM 767/4885SLC1A3 875/4885SLC1A2 1026/4885
US-20080227754-A1 PRODRUGS OF PHOSPHONATE NUCLEOTIDE ANALOGUES PNP, TYMP, APRT PKM 1050/4885SLC1A3 1257/4885SLC1A2 1895/4885
US-20050124585-A1 Prodrugs of phosphonate nucleotide analogues PNP, TYMP, APRT PKM 1050/4885SLC1A3 1257/4885SLC1A2 1895/4885

“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.