SCHEMBL20465441

SCHEMBL20465441

Cc1oc(=O)oc1COC(=O)N[C@@H](CCC(=O)C=[N+]=[N-])C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 2/20 0.36
▸ TGM2 P21980 4/20 0.36
▸ TYR P14679 2/20 0.34
▸ SIRT2 Q8IXJ6 1/20 0.32
▸ SIRT1 Q96EB6 1/20 0.32
▸ CTSL P07711 1/20 0.32
▸ CTSB P07858 1/20 0.32
▸ CTSS P25774 1/20 0.32
▸ ITGB3 P05106 1/20 0.31
▸ ITGAV P06756 1/20 0.31
▸ ACE P12821 1/20 0.31

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
SCHEMBL20465446 1.00 FOLH1 (0.36) FOLH1TGM2TYRSIRT2SIRT1
SCHEMBL18451517 0.94 FOLH1 (0.33) FOLH1TGM2TYRSIRT2SIRT1
SCHEMBL18452620 0.91 L3MBTL1 (0.35) FOLH1TYR
SCHEMBL20465431 0.91 L3MBTL1 (0.35) FOLH1TYR
SCHEMBL23627653 0.90 FOLH1 (0.36) FOLH1TGM2TYRSIRT2SIRT1
SCHEMBL20465444 0.89 FOLH1 (0.31) FOLH1
SCHEMBL20465423 0.89 FOLH1 (0.31) FOLH1
SCHEMBL18476659 0.86 TGM2 (0.44) FOLH1TGM2TYRSIRT2SIRT1
SCHEMBL21469698 0.86 FOLH1 (0.38) FOLH1TGM2TYRSIRT2SIRT1
SCHEMBL30799800 0.83 FOLH1 (0.40) FOLH1TGM2TYRSIRT2SIRT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11759444-B2 Methods for cancer and immunotherapy using prodrugs of glutamine analogs THE JOHNS HOPKINS UNIVERSITY (US) 2023-09-19 — — US disclosed
US-20210206787-A1 PRODRUGS OF GLUTAMINE ANALOGS Ústav organické chemie a biochemie AV CR, v.v.i. (CZ) 2021-07-08 — — US disclosed
US-20180221337-A1 METHODS AND COMPOSITIONS FOR TREATING METABOLIC REPROGRAMMING DISORDERS DEERFIELD MANAGEMENT COMPANY, L.P. (SERIES C), AS COLLATERAL AGENT 2018-08-09 — — US disclosed
US-20180222930-A1 PRODRUGS OF GLUTAMINE ANALOGS DEERFIELD MANAGEMENT COMPANY, L.P. (SERIES C), AS COLLATERAL AGENT 2018-08-09 — — US disclosed
US-20180221395-A1 METHODS FOR CANCER AND IMMUNOTHERAPY USING PRODRUGS OF GLUTAMINE ANALOGS UNIV JOHNS HOPKINS (US) 2018-08-09 — — US disclosed
US-20180193362-A1 GLUTAMINE ANTAGONISTS FOR THE TREATMENT OF COGNITIVE DEFICITS AND PSYCHIATRIC DISORDERS ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI 2018-07-12 — — 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 (6 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-20210206787-A1 PRODRUGS OF GLUTAMINE ANALOGS GLUL, GLS, GLS2 FOLH1 44/4885TGM2 97/4885TYR 3163/4885
US-20180193362-A1 GLUTAMINE ANTAGONISTS FOR THE TREATMENT OF COGNITIVE DEFICITS AND PSYCHIATRIC DISORDERS GLUL, GLS2, SLC1A2 FOLH1 1528/4885TGM2 107/4885TYR 2384/4885
US-11759444-B2 Methods for cancer and immunotherapy using prodrugs of glutamine analogs ADORA2A, ADORA1, ADORA2B FOLH1 189/4885TGM2 416/4885TYR 2869/4885
US-20180221337-A1 METHODS AND COMPOSITIONS FOR TREATING METABOLIC REPROGRAMMING DISORDERS GLS, GLS2, PC FOLH1 1804/4885TGM2 302/4885TYR 3362/4885
US-20180222930-A1 PRODRUGS OF GLUTAMINE ANALOGS GLUL, GLS, GLS2 FOLH1 403/4885TGM2 57/4885TYR 2744/4885
US-20180221395-A1 METHODS FOR CANCER AND IMMUNOTHERAPY USING PRODRUGS OF GLUTAMINE ANALOGS ADORA2A, ADORA1, ADORA2B FOLH1 189/4885TGM2 416/4885TYR 2869/4885

“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.

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