Ethylenediamine

Ethylenediamine

SCHEMBL2218952

NCCN.O=C(O)C(O)N(O)c1ccccc1

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D

The experimentally established mechanism targets of Ethylenediamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 1/20 0.40
NPSR1 Q6W5P4 2/20 0.38
SLC1A3 P43003 2/20 0.37
SLC1A2 P43004 2/20 0.37
SLC1A1 P43005 2/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
LMNA P02545 3/20 0.36
MAPK1 P28482 1/20 0.36
ALDH1A1 P00352 3/20 0.36
KMT2A Q03164 2/20 0.36
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
ALPI P09923 1/20 0.36
PKM P14618 1/20 0.36
PTGS1 P23219 1/20 0.36
XIAP P98170 1/20 0.36
SLC7A5 Q01650 1/20 0.36

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
Ethylenediamine SCHEMBL7109144 1.00 ADRA2C (0.40) ADRA2CNPSR1SLC1A3SLC1A2SLC1A1
SCHEMBL449666 0.90 NPSR1 (0.44) NPSR1LMNAMAPK1ALDH1A1KMT2A
SCHEMBL449664 0.90 NPSR1 (0.44) NPSR1LMNAMAPK1ALDH1A1KMT2A
SCHEMBL329145 0.71 NPSR1 (0.41) NPSR1SLC1A3SLC1A2SLC1A1LMNA
SCHEMBL9283942 0.71 NPSR1 (0.41) NPSR1SLC1A3SLC1A2SLC1A1LMNA
SCHEMBL329144 0.71 NPSR1 (0.41) NPSR1SLC1A3SLC1A2SLC1A1LMNA
SCHEMBL9283953 0.71 NPSR1 (0.41) NPSR1SLC1A3SLC1A2SLC1A1LMNA
SCHEMBL9283956 0.71 NPSR1 (0.41) NPSR1LMNAMAPK1ALDH1A1KMT2A
SCHEMBL329146 0.71 NPSR1 (0.41) ADRA2CNPSR1LMNAMAPK1ALDH1A1
SCHEMBL11569052 0.69 TSHR (0.41) ADRA2CNPSR1SLC1A2LMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110177004-A1 Version of FDG Detectable by Single-Photon Emission Computed Tomography OCERA THERAPEUTICS LLC (F/K/A OCERA THERAPEUTICS, INC.) 2011-07-21 US claimed
EP-2451776-B1 N-ALKOXYAMIDE CONJUGATES AS IMAGING AGENTS LANTHEUS MEDICAL IMAGING INC (US) 2019-09-18 EP disclosed
US-9732047-B2 N-alkoxyamide conjugates as imaging agents LANTHEUS MEDICAL IMAGING, INC. (US) 2017-08-15 US disclosed
EP-2240206-B1 N-ALKOXYAMIDE CONJUGATES AS IMAGING AGENTS LANTHEUS MEDICAL IMAGING INC (US) 2017-03-22 EP disclosed
US-20170029386-A9 N-ALKOXYAMIDE CONJUGATES AS IMAGING AGENTS LANTHEUS MEDICAL IMAGING, INC. (US) 2017-02-02 US disclosed
US-9393329-B2 N-alkoxyamide conjugates as imaging agents LANTHEUS MEDICAL IMAGING, INC. (US) 2016-07-19 US disclosed
US-20160185737-A1 N-ALKOXYAMIDE CONJUGATES AS IMAGING AGENTS LANTHEUS MEDICAL IMAGING, INC. (US) 2016-06-30 US disclosed
US-9266846-B2 N-alkoxyamide conjugates as imaging agents LANTHEUS MEDICAL IMAGING, INC. (US) 2016-02-23 US disclosed
US-9217009-B2 Version of FDG detectable by single-photon emission computed tomography MALLINCKRODT LLC (US) 2015-12-22 US disclosed
US-20150094465-A1 N-ALKOXYAMIDE CONJUGATES AS IMAGING AGENTS LANTHEUS MEDICAL IMAGING, INC. (US) 2015-04-02 US disclosed
EP-0888130-A2 NEW TERNARY RADIOPHARMACEUTICAL COMPLEXES Du Pont Pharmaceuticals Company (US) 1999-01-07 EP disclosed
US-5750088-A IMAGING AGENTS FOR DIAGNOSIS OF CARDIOVASCULAR DISORDERS,INFECTIONS, INFLAMMATION, CANCER THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) 1998-05-12 US disclosed
US-5744120-A PHOSPHINE OR ARSINE LIGATED TECHNETIUM-99M LABELED HYDRAZINO OR DIAZINO MODIFIED BIOLOGICALLY ACTIVE MOLECULES THAT SELECTIVELY LOCALIZE AT SITES OF DISEASE THE DUPONT MERICK PHARMACEUTICAL COMPANY (US) 1998-04-28 US disclosed
WO-1998015295-A2 RADIOPHARMACEUTICALS FOR IMAGING INFECTION AND INFLAMMATION DUPONT PHARMACEUTICALS COMPANY (US) 1998-04-16 WO disclosed
EP-0832068-A1 STABLE REAGENTS FOR THE PREPARATION OF RADIOPHARMACEUTICALS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1998-04-01 EP disclosed
EP-0820312-A4 TERNARY RADIOPHARMACEUTICAL COMPLEXES DU PONT MERCK PHARMA (US) 1998-03-18 EP disclosed
EP-0820312-A1 TERNARY RADIOPHARMACEUTICAL COMPLEXES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1998-01-28 EP disclosed
WO-1997033627-A2 NEW TERNARY RADIOPHARMACEUTICAL COMPLEXES DU PONT PHARMACEUTICALS COMPANY (US) 1997-09-18 WO disclosed
WO-1996040637-A1 STABLE REAGENTS FOR THE PREPARATION OF RADIOPHARMACEUTICALS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1996-12-19 WO disclosed
WO-1996031243-A1 TERNARY RADIOPHARMACEUTICAL COMPLEXES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1996-10-10 WO 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-20110177004-A1 Version of FDG Detectable by Single-Photon Emission Computed Tomography SLC2A1, SLC2A4, SLC2A3 ADRA2C 3433/4885NPSR1 4448/4885SLC1A3 193/4885
US-20150094465-A1 N-ALKOXYAMIDE CONJUGATES AS IMAGING AGENTS TNNT2, UACA, ELANE ADRA2C 3006/4885NPSR1 463/4885SLC1A3 2655/4885
US-20170029386-A9 N-ALKOXYAMIDE CONJUGATES AS IMAGING AGENTS TNNT2, UACA, ELANE ADRA2C 3006/4885NPSR1 463/4885SLC1A3 2655/4885
US-20160185737-A1 N-ALKOXYAMIDE CONJUGATES AS IMAGING AGENTS TNNT2, UACA, ELANE ADRA2C 3006/4885NPSR1 463/4885SLC1A3 2655/4885

“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.