SCHEMBL5000789

SCHEMBL5000789

N[C@@H](Cn1cc(F)c(=O)[nH]c1=O)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 10/20 1.00
GRIA2 P42262 9/20 1.00
GRIA4 P48058 9/20 1.00
GRIK5 Q16478 9/20 1.00
CYP1A2 P05177 2/20 1.00
KDM4E B2RXH2 1/20 1.00
GRIA3 P42263 1/20 1.00
KMT2A Q03164 2/20 0.69
BLM P54132 1/20 0.69
HSD17B10 Q99714 1/20 0.69
LMNA P02545 2/20 0.48
GRIK1 P39086 1/20 0.45

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
SCHEMBL8296644 1.00 GRIA1 (1.00) GRIA1GRIA2GRIA4GRIK5CYP1A2
SCHEMBL12648446 0.82 GRIA1 (1.00) GRIA1GRIA2GRIA4GRIK5CYP1A2
SCHEMBL8631021 0.82 GRIA1 (0.69) GRIA1GRIA2GRIA4GRIK5CYP1A2
SCHEMBL13957600 0.82 GRIA1 (0.69) GRIA1GRIA2GRIA4GRIK5CYP1A2
SCHEMBL4311549 0.82 GRIA1 (1.00) GRIA1GRIA2GRIA4GRIK5CYP1A2
SCHEMBL401659 0.82 GRIA1 (1.00) GRIA1GRIA2GRIA4GRIK5CYP1A2
SCHEMBL14478236 0.80 GRIA1 (0.66) GRIA1GRIA2GRIA4GRIK5CYP1A2
SCHEMBL25312715 0.79 GRIA1 (0.66) GRIA1GRIA2GRIA4GRIK5CYP1A2
SCHEMBL29499324 0.79 GRIA1 (0.64) GRIA1GRIA2GRIA4GRIK5CYP1A2
SCHEMBL12113221 0.77 GRIA1 (0.62) GRIA1GRIA2GRIA4GRIK5CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220142960-A1 Compositions and Methods for Treating Metabolic Disorders VEROSCIENCE LLC 2022-05-12 US claimed
US-12059404-B2 Mesembrenol and/or mesembranol for prophylaxis and treatment of patients suffering from epilepsy and associated diseases HG&H PHARMACEUTICALS (PTY) LTD (ZA) 2024-08-13 US disclosed
EP-3681504-B1 METHODS OF DETECTION USING X-RAY FLUORESCENCE ICAGEN INC (US) 2023-08-23 EP disclosed
US-11573224-B2 Methods of detection using X-ray fluorescence ICAGEN, LLC (US) 2023-02-07 US disclosed
US-11446398-B2 Regulated biocircuit systems OBSIDIAN THERAPEUTICS, INC. (US) 2022-09-20 US disclosed
US-20220142960-A1 Compositions and Methods for Treating Metabolic Disorders VEROSCIENCE LLC 2022-05-12 US disclosed
US-20210254056-A1 IDENTIFICATION AND TARGETED MODULATION OF GENE SIGNALING NETWORKS CAMP4 THERAPEUTICS CORPORATION 2021-08-19 US disclosed
US-10877035-B2 Advanced drug development and manufacturing ICAGEN, LLC (US) 2020-12-29 US disclosed
US-20200278346-A1 METHODS OF DETECTION USING X-RAY FLUORESCENCE ADJACENT ACQUISITION CO., LLC 2020-09-03 US disclosed
EP-3681504-A1 METHODS OF DETECTION USING X-RAY FLUORESCENCE Icagen, Inc. (US) 2020-07-22 EP disclosed
EP-2084519-B1 X-RAY FLUORESCENCE ANALYSIS METHOD LOS ALAMOS NAT SECURITY LLC (US) 2012-08-01 EP disclosed
US-7858560-B2 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions CAPROTEC BIOANALYTICS GMBH (DE) 2010-12-28 US disclosed
US-20100298168-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions HK PHARMACEUTICALS, INC. 2010-11-25 US disclosed
US-20100248264-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions HK PHARMACEUTICALS, INC. 2010-09-30 US disclosed
US-20100196354-A1 GLUTAMATE RECEPTOR ANTAGONISTS AND METHODS OF USE THE JOHNS HOPKINS UNIVERSITY (US) 2010-08-05 US disclosed
US-20100196354-A1 GLUTAMATE RECEPTOR ANTAGONISTS AND METHODS OF USE THE JOHNS HOPKINS UNIVERSITY (US) 2010-08-05 US disclosed
US-20090018086-A1 Monomethylvaline Compounds Having Phenylalanine Side-Chain Replacements at the C-Terminus SEATTLE GENETICS, INC. (US) 2009-01-15 US disclosed
US-20090018086-A1 Monomethylvaline Compounds Having Phenylalanine Side-Chain Replacements at the C-Terminus SEATTLE GENETICS, INC. (US) 2009-01-15 US disclosed
EP-1485707-B1 CAPTURE COMPOUNDS, COLLECTIONS THEREOF AND METHODS FOR ANALYZING THE PROTEOME AND COMPLEX COMPOSITIONS CAPROTEC BIOANALYTICS GMBH (DE) 2009-01-14 EP disclosed
US-20080220441-A1 Advanced drug development and manufacturing THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2008-09-11 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 (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-12059404-B2 Mesembrenol and/or mesembranol for prophylaxis and treatment of patients suffering from epilepsy and associated diseases GRM3, GRM2, GRIN3A GRIA1 29/4885GRIA2 24/4885GRIA4 22/4885
US-20100196354-A1 GLUTAMATE RECEPTOR ANTAGONISTS AND METHODS OF USE GRM5, GRM1, GRM3 GRIA1 10/4885GRIA2 13/4885GRIA4 22/4885
US-20090018086-A1 Monomethylvaline Compounds Having Phenylalanine Side-Chain Replacements at the C-Terminus MMAB, DNPEP, MARCKS GRIA1 1555/4885GRIA2 1812/4885GRIA4 2150/4885
US-20100298168-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions CHLSN, PTMS, SRMS GRIA1 4708/4885GRIA2 4754/4885GRIA4 4724/4885

“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.