SCHEMBL7701831

SCHEMBL7701831

CC(C)CC(N=C=O)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RNPEP Q9H4A4 1/20 0.41
SLC7A5 Q01650 1/20 0.41
ALDH1A1 P00352 3/20 0.36
SLC1A3 P43003 1/20 0.36
SLC1A2 P43004 1/20 0.36
CPA1 P15085 2/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
KMT2A Q03164 1/20 0.34
TP53 P04637 1/20 0.33
CACNA2D1 P54289 2/20 0.32
MAPT P10636 1/20 0.32
CACNB3 P54284 1/20 0.32
CACNA1C Q13936 1/20 0.32
PGR P06401 1/20 0.32
ADRA1A P35348 1/20 0.32
HTR2B P41595 1/20 0.32
CACNA2D2 Q9NY47 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
SCHEMBL6056700 1.00 RNPEP (0.41) RNPEPSLC7A5ALDH1A1SLC1A3SLC1A2
Water SCHEMBL27284531 0.98 RNPEP (0.40) RNPEPSLC7A5ALDH1A1SLC1A3SLC1A2
SCHEMBL27747260 0.86 PLA2G2A (0.34) RNPEPSLC7A5SLC1A3SLC1A2MAPT
SCHEMBL11158578 0.86 CYP3A4 (0.31) LMNAMAPT
SCHEMBL28822953 0.85 RNPEP (0.31) RNPEPSLC7A5
Leucine SCHEMBL15689481 0.85 SLC7A5 (0.56) RNPEPSLC7A5SLC1A3SLC1A2
Ammonia Solution, Strong SCHEMBL27843508 0.85 PLA2G2A (0.33) RNPEPSLC7A5MAPT
SCHEMBL12485048 0.83 GSR (0.40) RNPEPSLC7A5SLC1A3SLC1A2CACNA2D1
SCHEMBL7953742 0.80
SCHEMBL27693374 0.80 ACE (0.43) ALDH1A1CPA1MEN1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11981753-B2 Peptide compound and application thereof, and composition containing peptide compound SHANGPHARMA INNOVATION INC. (US) 2024-05-14 US disclosed
CN-116813705-A Peptide compound, application thereof and composition containing peptide compound 凯惠科技发展(上海)有限公司 2023-09-29 CN disclosed
CN-109206481-B Peptide compound, application thereof and composition containing peptide compound 尚华医药科技(江西)有限公司 2023-08-18 CN disclosed
US-20230159453-A1 INHIBITORS OF NOROVIRUS AND CORONAVIRUS REPLICATION COCRYSTAL PHARMA, INC. 2023-05-25 US disclosed
US-20230150933-A1 BROAD SPECTRUM ANTIVIRALS AGAINST CORONAVIRUS UNIVERSITY OF IOWA RESEARCH FOUNDATION 2023-05-18 US disclosed
EP-4132944-A1 INHIBITORS OF NOROVIRUS AND CORONAVIRUS REPLICATION Cocrystal Pharma, Inc. (US) 2023-02-15 EP disclosed
EP-4126816-A1 BROAD SPECTRUM ANTIVIRALS AGAINST CORONAVIRUS Kansas State University Research Foundation (US) 2023-02-08 EP disclosed
CN-115698035-A Inhibitors of norovirus and coronavirus replication 共晶制药公司 2023-02-03 CN disclosed
WO-2021202460-A1 BROAD SPECTRUM ANTIVIRALS AGAINST CORONAVIRUS KANSAS STATE UNIVERSITY RESEARCH FOUNDATION (US) 2021-10-07 WO disclosed
US-20200172575-A1 PEPTIDE COMPOUND AND APPLICATION THEREOF, AND COMPOSITION CONTAINING PEPTIDE COMPOUND XDCEXPLORER (SHANGHAI) CO., LTD. (CN) 2020-06-04 US disclosed
CN-1261276-A Protease inhibitors SMITHKLINE BEECHAM CORP (US) 2000-07-26 CN disclosed
WO-2000035885-A1 CYCLIC HYDRAZINE DERIVATIVES AS TNF-ALPHA INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2000-06-22 WO disclosed
CN-1255119-A Protease inhibitors SMITHKLINE BEECHAM CORP (US) 2000-05-31 CN disclosed
CN-1195343-A Piperazine derivatives and use of same SENJU PHARMA CO (JP) 1998-10-07 CN disclosed
CN-1163145-A Inhibiting agent for vascular formation SENJI SEIYAKU K K (JP) 1997-10-29 CN disclosed
CN-1141773-A Preparation of medicine containing 6-oxo-azitropilidene indole KALI CHEMIE PHARMA GMBH (DE) 1997-02-05 CN disclosed
CN-1136813-A Novel synthetic peptide, lung surfactant containing the same and remedy for respiratory distress syndrome TOKYO TANABE PHARMACEUTICAL CO (JP) 1996-11-27 CN disclosed
CN-1069733-A 6-OXO-AZA * INDOLES, PROCESS FOR THEIR PRODUCTION, INTERMEDIATE PRODUCTS AND PHARMACEUTICAL APPLICATIONS KALI CHEMIE PHARMA GMBH (DE) 1993-03-10 CN disclosed
CN-1039026-A The method for preparing trinucleated 3-oxo-propanenitrile derivatives ERBA CARLO SPA (IT) 1990-01-24 CN disclosed
CN-86107574-A Compositions containing penem or carbapenem antibiotics and their use 1987-05-20 CN 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 (4 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-11981753-B2 Peptide compound and application thereof, and composition containing peptide compound KISS1R, NPY1R, GLP1R RNPEP 712/4885SLC7A5 831/4885ALDH1A1 4788/4885
US-20230159453-A1 INHIBITORS OF NOROVIRUS AND CORONAVIRUS REPLICATION VIM, ACE, ACE2 RNPEP 279/4885SLC7A5 1967/4885ALDH1A1 1895/4885
US-20200172575-A1 PEPTIDE COMPOUND AND APPLICATION THEREOF, AND COMPOSITION CONTAINING PEPTIDE COMPOUND KISS1R, VIP, NPY1R RNPEP 311/4885SLC7A5 400/4885ALDH1A1 4326/4885
US-20230150933-A1 BROAD SPECTRUM ANTIVIRALS AGAINST CORONAVIRUS SARS1, ZC3HAV1, POLL RNPEP 452/4885SLC7A5 1182/4885ALDH1A1 2499/4885

“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.