SCHEMBL468949

SCHEMBL468949

CN[C@@H](CCCNC(N)N)C(C)=O

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KISS1R Q969F8 1/20 0.36
NOD1 Q9Y239 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
SCHEMBL14951121 0.89 NOD1 (0.32) NOD1
SCHEMBL22919489 0.87 KISS1R (0.35) KISS1RNOD1
SCHEMBL20227446 0.85 NOD1 (0.40) NOD1
SCHEMBL20032178 0.85 NOD1 (0.40) NOD1
SCHEMBL14393113 0.84 NOD1 (0.33) KISS1RNOD1
SCHEMBL14614152 0.84 NOD1 (0.31) NOD1
SCHEMBL15304756 0.84 KISS1R (0.32) KISS1RNOD1
SCHEMBL23743653 0.81 KISS1R (0.36) KISS1R
SCHEMBL13366903 0.80 KISS1R (0.53) KISS1R
SCHEMBL14525182 0.80 KISS1R (0.53) KISS1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3532486-B1 ANTIBODY-COUPLED CYCLIC PEPTIDE TYROSINE TYROSINE COMPOUNDS AS MODULATORS OF NEUROPEPTIDE Y RECEPTORS JANSSEN PHARMACEUTICA NV (BE) 2021-09-22 EP disclosed
WO-2018081367-A1 CYCLIC PEPTIDE TYROSINE TYROSINE COMPOUNDS AS MODULATORS OF NEUROPEPTIDE Y RECEPTORS JANSSEN PHARMACEUTICA NV (BE) 2018-05-03 WO disclosed
EP-2598648-B1 N-GLYCOSYLATION IN TRANSFORMED PHAEODACTYLUM TRICORNUTUM Université de Rouen (FR) 2017-11-08 EP disclosed
US-20170304383-A1 SMALL MOLECULE RAS INHIBITORS OHIO STATE INNOVATION FOUNDATION 2017-10-26 US disclosed
WO-2017117411-A1 ANALOGUES OF HEPCIDIN MIMETICS WITH IMPROVED IN VIVO HALF LIVES PROTAGONIST THERAPEUTICS, INC. (US) 2017-07-06 WO disclosed
WO-2015188934-A1 CONJUGATE COMPRISING A NEUROTENSIN RECEPTOR LIGAND AND USE THEREOF 3B PHARMACEUTICALS GMBH (DE) 2015-12-17 WO disclosed
EP-1984384-B1 Conotoxin analogues, and methods for synthesis of intramolecular dicarba bridge containing peptides SYNGENE LTD (AU) 2015-10-21 EP disclosed
US-20150093787-A1 COMPOSITIONS AND METHODS FOR USE IN RECOMBINATIONAL CLONING OF NUCLEIC ACIDS LIFE TECHNOLOGIES CORP (US) 2015-04-02 US disclosed
US-8924597-B2 Domain management processor HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2014-12-30 US disclosed
US-8883988-B2 Compositions for use in recombinational cloning of nucleic acids Life Technologies Corporation (US) 2014-11-11 US disclosed
US-20080090768-A1 RECOMBINANT BONE MORPHOGENETIC PROTEIN HETERODIMERS, COMPOSITIONS AND METHODS OF USE GENETICS INSTITUTE, INC. 2008-04-17 US disclosed
US-20080070842-A1 RECOMBINANT BONE MORPHOGENETIC PROTEIN HETERODIMERS, COMPOSITIONS AND METHODS OF USE GENETICS INSTITUTE, INC. 2008-03-20 US disclosed
EP-1857466-A2 Soluble interleukin-20 receptor ZymoGenetics, Inc. (US) 2007-11-21 EP disclosed
EP-1585752-B1 POLYENE POLYKETIDES, PROCESSES FOR THEIR PRODUCTION AND THEIR USE AS A PHARMACEUTICAL THALLION PHARMACEUTICALS INC (CA) 2007-11-21 EP disclosed
US-20070253971-A1 Immunogenic composition of vector; diagnostic immunoassays, probes and primers; host cells, genetic vaccines; administering to pregnant pigs WYETH 2007-11-01 US disclosed
US-20070184513-A1 Substrates for beta-lactamase and uses thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-08-09 US disclosed
US-7244613-B2 Expression vector comprising nucleotide sequences coding tubercular complex for use in developing vaccines for treatment and prevention of respiratory system disorders; bactericides INSTITUT PASTEUR (FR) 2007-07-17 US disclosed
EP-1775590-A1 Non-invasive in vitro method to detect transitional cell carcinoma of the bladder LABORATORIOS S.A.L.V.A.T., S.A. (ES) 2007-04-18 EP disclosed
US-7184893-B2 Method for selecting an optimally diverse library of small molecules based on validated molecular structural descriptors TRIPOS, INC. (US) 2007-02-27 US disclosed
US-20070031864-A1 Polyvalent cation-sensing receptor in atlantic salmon HARRIS H W JR 2007-02-08 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-20170304383-A1 SMALL MOLECULE RAS INHIBITORS KRAS, NRAS, HRAS KISS1R 4791/4885NOD1 4320/4885
US-20070184513-A1 Substrates for beta-lactamase and uses thereof CMBL, DBH, NCEH1 KISS1R 3554/4885NOD1 3633/4885

“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.