SCHEMBL2491591

SCHEMBL2491591

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

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.47
ANPEP P15144 3/20 0.40
RNPEP Q9H4A4 2/20 0.40
DNPEP Q9ULA0 1/20 0.40
MME P08473 2/20 0.39
SLC1A3 P43003 1/20 0.37
SLC1A2 P43004 1/20 0.37
CA14 Q9ULX7 1/20 0.35
FOLH1 Q04609 1/20 0.35
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
LARS1 Q9P2J5 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
BIRC2 Q13490 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL28856641 1.00 SLC7A5 (0.47) SLC7A5ANPEPRNPEPDNPEPMME
SCHEMBL2489676 1.00 SLC7A5 (0.47) SLC7A5ANPEPRNPEPDNPEPMME
Isothiocyanate SCHEMBL2490540 0.91 SLC7A5 (0.45) SLC7A5ANPEPRNPEPDNPEPMME
SCHEMBL700933 0.90 SLC7A5 (0.56) SLC7A5ANPEPRNPEPDNPEPMME
SCHEMBL196338 0.90 SLC7A5 (0.56) SLC7A5ANPEPRNPEPDNPEPMME
SCHEMBL76796 0.90 SLC7A5 (0.56) SLC7A5ANPEPRNPEPDNPEPMME
SCHEMBL29783468 0.90 SLC7A5 (0.56) SLC7A5ANPEPRNPEPDNPEPMME
Hydrochloric Acid SCHEMBL353346 0.88 SLC7A5 (0.54) SLC7A5ANPEPRNPEPDNPEPMME
Hydrochloric Acid SCHEMBL76795 0.88 SLC7A5 (0.54) SLC7A5ANPEPRNPEPDNPEPMME
Hydrochloric Acid SCHEMBL355415 0.88 SLC7A5 (0.54) SLC7A5ANPEPRNPEPDNPEPMME

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8059592-A None JP disclosed
CN-115667215-B Broad-spectrum antiviral medicine for resisting coronavirus 堪萨斯州立大学研究基金会 2026-05-19 CN disclosed
US-12583820-B2 Broad spectrum antivirals against coronavirus KANSAS STATE UNIVERSITY RESEARCH FOUNDATION (US) 2026-03-24 US disclosed
WO-2023106377-A1 METHOD FOR PRODUCING BLOCKED ISOCYANATE COMPOUND AND METHOD FOR PRODUCING ISOCYANATE COMPOUND 旭化成株式会社 2023-06-15 WO disclosed
US-20230150933-A1 BROAD SPECTRUM ANTIVIRALS AGAINST CORONAVIRUS UNIVERSITY OF IOWA RESEARCH FOUNDATION 2023-05-18 US disclosed
WO-2023080257-A1 METHOD FOR PRODUCING ISOCYANATE COMPOUNDS, METHOD FOR PRODUCING CARBAMATE COMPOUNDS, METHOD FOR RECOVERING AMINE COMPOUNDS, AND ISOCYANATE COMPOSITION 旭化成株式会社 2023-05-11 WO disclosed
US-20230135772-A1 CARBODIIMIDE COMPOSITION, CURING AGENT COMPOSITION, COATING COMPOSITION AND RESIN CURED PRODUCT ASAHI KASEI KABUSHIKI KAISHA (JP) 2023-05-04 US disclosed
EP-4126816-A1 BROAD SPECTRUM ANTIVIRALS AGAINST CORONAVIRUS Kansas State University Research Foundation (US) 2023-02-08 EP disclosed
EP-4130154-A1 CARBODIIMIDE COMPOSITION, HARDENER COMPOSITION, COATING COMPOSITION, AND CURED RESIN OBJECT Asahi Kasei Kabushiki Kaisha (JP) 2023-02-08 EP disclosed
CN-115667215-A Broad-spectrum antiviral medicine for resisting coronavirus 堪萨斯州立大学研究基金会 2023-01-31 CN disclosed
US-20080221123-A1 Piperazinone Compounds as Anti-Tumor and Anti-Cancer Agents and Methods of Treatment YALE UNIVERSITY 2008-09-11 US disclosed
EP-1427418-A4 PIPERAZINONE COMPOUNDS AS ANTI-TUMOR AND ANTI-CANCER AGENTS AND METHODS OF TREATMENT UNIV YALE (US) 2004-11-17 EP disclosed
EP-1427418-A2 PIPERAZINONE COMPOUNDS AS ANTI-TUMOR AND ANTI-CANCER AGENTS AND METHODS OF TREATMENT YALE UNIVERSITY (US) 2004-06-16 EP disclosed
WO-2003017939-A2 PIPERAZINONE COMPOUNDS AS ANTI-TUMOR AND ANTI-CANCER AGENTS AND METHODS OF TREATMENT YALE UNIVERSITY (US) 2003-03-06 WO disclosed
JP-H0859592-A LEUCINE-ALKYL ESTER ISOCYANATE, ITS PRODUCTION AND POLYMER THEREOF AIBAITSU KK 1996-03-05 JP disclosed
US-4740611-A N,N'-disubstituted ureas THE STANDARD OIL COMPANY (US) 1988-04-26 US disclosed
US-4705864-A Aryl oxime derivatives of hydantoins THE STANDARD OIL COMPANY (US) 1987-11-10 US disclosed
US-4691007-A HUMAN LEUKOCYTE ELASTASE INHIBITORS ICI AMERICAS INC. (US) 1987-09-01 US disclosed
US-4596789-A Pharmaceuticals ICI AMERICAS INC. (US) 1986-06-24 US disclosed
EP-0124317-A2 Proline derivatives ICI AMERICAS INC. (US) 1984-11-07 EP 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 (3 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-12583820-B2 Broad spectrum antivirals against coronavirus SARS1, NSUN2, ZC3HAV1 SLC7A5 852/4885ANPEP 1527/4885RNPEP 1664/4885
US-20080221123-A1 Piperazinone Compounds as Anti-Tumor and Anti-Cancer Agents and Methods of Treatment EP300, HDAC5, VHL SLC7A5 4513/4885ANPEP 2132/4885RNPEP 3928/4885
US-20230150933-A1 BROAD SPECTRUM ANTIVIRALS AGAINST CORONAVIRUS SARS1, ZC3HAV1, POLL SLC7A5 1182/4885ANPEP 843/4885RNPEP 452/4885

“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.