SCHEMBL2585866

SCHEMBL2585866

N=C(N)NCCC[C@H](N)C(=O)Nc1ccc2ccccc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.47
DPP8 Q6V1X1 1/20 0.45
DPP9 Q86TI2 1/20 0.45
DPP7 Q9UHL4 1/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
MAPT P10636 3/20 0.44
POLB P06746 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
GAA P10253 1/20 0.43
CMA1 P23946 2/20 0.43
LTA4H P09960 1/20 0.42
CYP1A2 P05177 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP2C19 P33261 1/20 0.42
HIF1A Q16665 1/20 0.42
CXCR4 P61073 2/20 0.42

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
SCHEMBL29359776 1.00 EPHX1 (0.47) EPHX1DPP8DPP9DPP7MEN1
Hydrochloric Acid SCHEMBL4087778 0.99 EPHX1 (0.46) EPHX1DPP8DPP9DPP7MEN1
SCHEMBL8341764 0.91 NPY4R (0.47) EPHX1DPP8DPP9DPP7MEN1
SCHEMBL27352129 0.91 NPY4R (0.47) EPHX1DPP8DPP9DPP7MEN1
Dl-Phenylalanine SCHEMBL20580864 0.91 LTA4H (0.43) EPHX1LTA4HSLC1A3SLC1A2SLC1A1
Phenylalanine SCHEMBL18953085 0.91 LTA4H (0.43) EPHX1LTA4HSLC1A3SLC1A2SLC1A1
SCHEMBL9490109 0.90 TERT (0.51) EPHX1DPP8DPP9DPP7MEN1
SCHEMBL8338954 0.87 NPY4R (0.46) EPHX1DPP8DPP9DPP7LTA4H
SCHEMBL13437223 0.85 EPHX1 (0.47) EPHX1MEN1KMT2AMAPTPOLB
SCHEMBL8768680 0.85 LTA4H (0.47) EPHX1POLBRAB9ASMN1; SMN2LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0165905-B1 DIAGNOSTIC ASSAY METHOD FOR THE DETECTION OF ORAL PATHOGENIC BACTERIA MIXTURES THE BOARD OF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1989-03-08 EP claimed
US-4603108-A Method for identification of bacterial species NATIONAL RESEARCH DEVELOPMENT CORP. (GB) 1986-07-29 US claimed
EP-0165905-A1 Diagnostic assay method for the detection of oral pathogenic bacteria mixtures THE BOARD OF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1985-12-27 EP claimed
EP-0018825-B1 A PROCESS FOR THE IDENTIFICATION OF BACTERIA AND A KIT OF REAGENTS FOR USE IN THIS PROCESS NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1985-02-13 EP claimed
US-4208480-A Method, reagents and apparatus for the rapid identification of Neisseria gonorrhoeae and Neisseria meningitidis AMERICAN HOME PRODUCTS CORPORATION (US) 1980-06-17 US claimed
US-12377079-B2 Antibacterial compounds and uses thereof THE CHILDREN'S MEDICAL CENTER CORPORATION 2025-08-05 US disclosed
CN-119875841-A Microalgae culture method 中国石油化工股份有限公司 2025-04-25 CN disclosed
WO-2023088470-A1 PROBIOTIC COMPOSITIONS FOR TREATMENT OF HAIR LOSS THE CHINESE UNIVERSITY OF HONG KONG (CN) 2023-05-25 WO disclosed
US-20220023270-A1 ANTIBACTERIAL COMPOUNDS AND USES THEREOF THE CHILDREN'S MEDICAL CENTER CORPORATION (US) 2022-01-27 US disclosed
US-10760112-B2 Enzymatic activity assays for glucocerebrosidase SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2020-09-01 US disclosed
CN-107751089-A It is a kind of that the method for resisting general resistance Acinetobacter bauamnnii medicine is screened using Caenorhabditis elegans 广州军区广州总医院 2018-03-06 CN disclosed
US-20180051315-A1 ENZYMATIC ACTIVITY ASSAYS FOR GLUCOCEREBROSIDASE SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2018-02-22 US disclosed
EP-0018825-A1 A process for the identification of bacteria and a kit of reagents for use in this process NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1980-11-12 EP disclosed
US-4208480-A Method, reagents and apparatus for the rapid identification of Neisseria gonorrhoeae and Neisseria meningitidis AMERICAN HOME PRODUCTS CORPORATION (US) 1980-06-17 US disclosed
US-4208480-A Method, reagents and apparatus for the rapid identification of Neisseria gonorrhoeae and Neisseria meningitidis AMERICAN HOME PRODUCTS CORPORATION (US) 1980-06-17 US disclosed
US-4189604-A PEPTIDASE ENZYME INHIBITORS ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1980-02-19 US disclosed
US-4185156-A 3-AMINO-2-HYDROXY-4-PHENYLBUTANOYLARGENINE, ENZYME INHIBITORS, ANTICANCER AGENTS ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1980-01-22 US disclosed
US-4179573-A (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoic acid ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1979-12-18 US disclosed
US-4052449-A BIOLOGICALLY ACTIVE SUBSTANCE, BESTATIN, AND PRODUCTION THEREOF ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JA) 1977-10-04 US disclosed
US-4029547-A Biologically active substance, bestatin, and production thereof ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JA) 1977-06-14 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-12377079-B2 Antibacterial compounds and uses thereof CLPP, SPOUT1, MRPL21 EPHX1 3423/4885DPP8 142/4885DPP9 76/4885
US-20220023270-A1 ANTIBACTERIAL COMPOUNDS AND USES THEREOF CLPP, SPOUT1, MRPL21 EPHX1 3423/4885DPP8 142/4885DPP9 76/4885

“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.