SCHEMBL353510

SCHEMBL353510

NC(CCC[C@H](N)C(=O)O)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM8 O00222 8/20 0.52
GRM4 Q14833 8/20 0.52
KMO O15229 1/20 0.50
CYP3A4 P08684 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CASR P41180 1/20 0.47
GRM6 O15303 5/20 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
SCHEMBL27786209 1.00 GRM8 (0.52) GRM8GRM4KMOCYP3A4SMN1; SMN2
Dinitrophenylene SCHEMBL28977791 0.74 KMO (0.58) GRM8GRM4KMOGRM6
SCHEMBL7511838 0.73 GRM8 (0.51) GRM8GRM4KMOCASRGRM6
SCHEMBL7511836 0.73 GRM8 (0.51) GRM8GRM4KMOCASRGRM6
SCHEMBL9755844 0.73 POLB (0.51)
SCHEMBL10591572 0.73 POLB (0.51)
Trinitrophenol SCHEMBL3985940 0.72 GRM8 (0.57) GRM8GRM4GRM6
Trinitrophenol SCHEMBL3985938 0.72 GRM8 (0.57) GRM8GRM4GRM6
SCHEMBL3124322 0.72 GRM8 (0.53) GRM8GRM4GRM6
SCHEMBL11591209 0.71 GRM8 (0.50) GRM8GRM4KMOGRM6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10196428-B2 Modification of cupredoxin derived peptides NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2019-02-05 US claimed
US-20170174729-A1 MODIFICATION OF CUPREDOXIN DERIVED PEPTIDES AND METHODS OF USE THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2017-06-22 US claimed
EP-2398490-A2 MODIFICATIONS OF CUPREDOXIN DERIVED PEPTIDES AND METHODS OF USE THEREOF Cdg Therapeutics Inc (US) 2011-12-28 EP claimed
US-20100267608-A1 MODIFICATIONS OF CUPREDOXIN DERIVED PEPTIDES AND METHODS OF USE THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-10-21 US claimed
WO-2010096681-A2 MODIFICATIONS OF CUPREDOXIN DERIVED PEPTIDES AND METHODS OF USE THEREOF CDG THERAPEUTICS, INC. (US) 2010-08-26 WO claimed
US-20090286719-A1 MODIFICATION OF CUPREDOXIN DERIVED PEPTIDES AND METHODS OF USE THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2009-11-19 US claimed
EP-2061487-A2 MODIFICATIONS OF CUPREDOXIN DERIVED PEPTIDES AND METHODS OF USE THEREOF The Board of Trustees of the University of Illinois (US) 2009-05-27 EP claimed
WO-2008033820-A2 MODIFICATIONS OF CUPREDOXIN DERIVED PEPTIDES AND METHODS OF USE THEREOF THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2008-03-20 WO claimed
US-20240124518-A1 METHODS FOR PREPARING PURIFIED POLYPEPTIDE COMPOSITIONS AILERON THERAPEUTICS INC (US) 2024-04-18 US disclosed
US-20220017569-A1 METHODS FOR PREPARING PURIFIED POLYPEPTIDE COMPOSITIONS AILERON THERAPEUTICS, INC. 2022-01-20 US disclosed
US-11046733-B2 Compositions and methods to treat cancer with CpG rich DNA and cupredoxins THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2021-06-29 US disclosed
US-10889621-B2 Compositions and methods for treating conditions related to ephrin signaling with Cupredoxins THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2021-01-12 US disclosed
US-20200172581-A1 COMPOSITIONS AND METHODS TO TREAT CANCER WITH CpG RICH DNA AND CUPREDOXINS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2020-06-04 US disclosed
US-10590177-B2 Modifications of cupredoxin derived peptides THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2020-03-17 US disclosed
WO-2007018671-A2 COMPOSITIONS AND METHODS FOR TREATING CONDITIONS RELATED TO EPHRIN SIGNALING WITH CUPREDOXINS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2007-02-15 WO disclosed
WO-2007012004-A2 TRANSPORT AGENTS FOR CROSSING THE BLOOD-BRAIN BARRIER AND INTO BRAIN CANCER CELLS, AND METHODS OF USE THEREOF THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2007-01-25 WO disclosed
WO-2006127477-A2 COMPOSITIONS AND METHODS FOR TREATING MALARIA WITH CUPREDOXIN AND CYTOCHROME THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2006-11-30 WO disclosed
WO-2006127514-A2 COMPOSITIONS AND METHODS FOR TREATING HIV INFECTION WITH CUPREDOXIN AND CYTOCHROME C THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2006-11-30 WO disclosed
US-20060251669-A1 Compositions and methods for treating malaria with cupredoxin and cytochrome NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2006-11-09 US disclosed
US-20060251639-A1 Compositions and methods for treating HIV infection with cupredoxin and cytochrame C BANK OF AMERICA, N.A., AS ADMINISTRATIVE AGENT 2006-11-09 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 (2 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-20240124518-A1 METHODS FOR PREPARING PURIFIED POLYPEPTIDE COMPOSITIONS VIP, NGLY1, IAPP GRM8 4136/4885GRM4 3767/4885KMO 4360/4885
US-20220017569-A1 METHODS FOR PREPARING PURIFIED POLYPEPTIDE COMPOSITIONS VIP, NGLY1, IAPP GRM8 4136/4885GRM4 3767/4885KMO 4360/4885

“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.