SCHEMBL21577845

SCHEMBL21577845

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

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SLC7A5 Q01650 1/20 0.58
▸ SLC1A3 P43003 5/20 0.52
▸ SLC1A2 P43004 5/20 0.52
▸ SLC1A1 P43005 4/20 0.52
▸ GRIK1 P39086 10/20 0.50
▸ GRIK2 Q13002 5/20 0.50
▸ GRIA4 P48058 3/20 0.50
▸ GRIK3 Q13003 3/20 0.50
▸ GRIK5 Q16478 3/20 0.50
▸ GRIA2 P42262 2/20 0.50
▸ GRIA1 P42261 1/20 0.50
▸ PTGS1 P23219 1/20 0.50
▸ SLC7A11 Q9UPY5 1/20 0.50
▸ GRM1 Q13255 1/20 0.48
▸ GRM2 Q14416 1/20 0.48
▸ GGT1 P19440 2/20 0.43

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
SCHEMBL21690060 1.00 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
SCHEMBL10212363 1.00 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
SCHEMBL21577850 0.86 SLC7A5 (0.54) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
SCHEMBL434919 0.85 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
SCHEMBL21585639 0.85 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
SCHEMBL380601 0.85 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
SCHEMBL434918 0.85 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
SCHEMBL21585654 0.83 SLC7A5 (0.56) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
SCHEMBL18261645 0.81 SLC7A5 (0.54) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
SCHEMBL12368601 0.80 ALDH1A1 (0.36) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112135812-B Ketamine derivatives and pharmaceutical compositions thereof 凯瑞康宁生物工程(武汉)有限公司 2022-01-18 — — CN claimed
EP-3710458-B1 IMMUNOPROTEASOME INHIBITORS PRINCIPIA BIOPHARMA INC (US) 2026-03-25 — — EP disclosed
US-12312370-B2 Immunoproteasome inhibitors PRINCIPIA BIOPHARMA INC. (US) 2025-05-27 — — US disclosed
US-20240199655-A1 Immunoproteasome Inhibitors PRINCIPIA BIOPHARMA INC. (US) 2024-06-20 — — US disclosed
CN-111491938-B Immunoproteasome inhibitors 普林斯匹亚生物制药公司 2024-05-24 — — CN disclosed
US-11827656-B2 Immunoproteasome inhibitors PRINCIPIA BIOPHARMA INC. (US) 2023-11-28 — — US disclosed
US-11649215-B2 Compositions and methods for the treatment of oral infectious diseases CELLIX BIO PRIVATE LIMITED (IN) 2023-05-16 — — US disclosed
US-20230000996-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF THE JOHNS HOPKINS UNIVERSITY 2023-01-05 — — US disclosed
US-11465973-B2 Compositions and methods for the treatment of oral infectious diseases CELLIX BIO PRIVATE LIMITED (IN) 2022-10-11 — — US disclosed
US-20220220079-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF ORAL INFECTIOUS DISEASES CELLIX BIO PRIVATE LIMITED (IN) 2022-07-14 — — US disclosed
US-11000487-B2 Compositions and methods for the treatment of chronic pain CELLIX BIO PRIVATE LIMITED (IN) 2021-05-11 — — US disclosed
US-20210094933-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF THE JOHNS HOPKINS UNIVERSITY 2021-04-01 — — US disclosed
US-20210053950-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF FUNGAL INFECTIONS CELLIX BIO PRIVATE LIMITED (IN) 2021-02-25 — — US disclosed
US-20210032194-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEUROLOGICAL DISEASES CELLIX BIO PRIVATE LIMITED (IN) 2021-02-04 — — US disclosed
US-20200361874-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF ORAL INFECTIOUS DISEASES CELLIX BIO PRIVATE LIMITED (IN) 2020-11-19 — — US disclosed
US-20200361912-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF FUNGAL INFECTIONS CELLIX BIO PRIVATE LIMITED (IN) 2020-11-19 — — US disclosed
EP-3710458-A1 IMMUNOPROTEASOME INHIBITORS Principia Biopharma Inc. (US) 2020-09-23 — — EP disclosed
US-20200277312-A1 IMMUNOPROTEASOME INHIBITORS PRINCIPIA BIOPHARMA INC. 2020-09-03 — — US disclosed
CN-111491938-A Immunoproteasome inhibitors 普林斯匹亚生物制药公司 2020-08-04 — — CN disclosed
US-20190350877-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF CHRONIC PAIN CELLIX BIO PRIVATE LIMITED (IN) 2019-11-21 — — 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 (15 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-11827656-B2 Immunoproteasome inhibitors PSMC2, PSMB7, PSMB2 SLC7A5 3751/4885SLC1A3 4197/4885SLC1A2 4190/4885
US-20220220079-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF ORAL INFECTIOUS DISEASES SI, HBG1, HBG2 SLC7A5 1984/4885SLC1A3 3752/4885SLC1A2 3415/4885
US-20240199655-A1 Immunoproteasome Inhibitors PSMC2, PSMB7, PSMB2 SLC7A5 3751/4885SLC1A3 4197/4885SLC1A2 4190/4885
US-20190350877-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF CHRONIC PAIN OPRK1, F5, F12 SLC7A5 2865/4885SLC1A3 2689/4885SLC1A2 2001/4885
US-11649215-B2 Compositions and methods for the treatment of oral infectious diseases SI, HBG1, HBG2 SLC7A5 1984/4885SLC1A3 3752/4885SLC1A2 3415/4885
US-20230000996-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF RICTOR, FKBP14, MTOR SLC7A5 2832/4885SLC1A3 4504/4885SLC1A2 4689/4885
US-20200277312-A1 IMMUNOPROTEASOME INHIBITORS PSMC2, PSMB7, PSMB2 SLC7A5 3751/4885SLC1A3 4197/4885SLC1A2 4190/4885
US-11465973-B2 Compositions and methods for the treatment of oral infectious diseases SI, HBG1, HBG2 SLC7A5 1984/4885SLC1A3 3752/4885SLC1A2 3415/4885
US-12312370-B2 Immunoproteasome inhibitors PSMC2, PSMB7, PSMB2 SLC7A5 3751/4885SLC1A3 4197/4885SLC1A2 4190/4885
US-20210053950-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF FUNGAL INFECTIONS SI, CYP3A7, ERG28 SLC7A5 2338/4885SLC1A3 3715/4885SLC1A2 3574/4885
US-20210094933-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF RICTOR, FKBP14, MTOR SLC7A5 2832/4885SLC1A3 4504/4885SLC1A2 4689/4885
US-20200361874-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF ORAL INFECTIOUS DISEASES SI, HBG1, HBG2 SLC7A5 1984/4885SLC1A3 3752/4885SLC1A2 3415/4885
US-20210032194-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEUROLOGICAL DISEASES SCNN1G, PMP22, TTR SLC7A5 1437/4885SLC1A3 486/4885SLC1A2 172/4885
US-20200361912-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF FUNGAL INFECTIONS SI, CYP3A7, ERG28 SLC7A5 2338/4885SLC1A3 3715/4885SLC1A2 3574/4885
US-11000487-B2 Compositions and methods for the treatment of chronic pain OPRK1, F5, F12 SLC7A5 2865/4885SLC1A3 2689/4885SLC1A2 2001/4885

“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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