SCHEMBL4120577

SCHEMBL4120577

CC1(C)CC(N)(C(=O)O)CC(C)(C)N1[O]

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 1/20 0.39
GRM4 Q14833 7/20 0.37
CYP1A2 P05177 4/20 0.37
CYP2C19 P33261 3/20 0.37
ALOX15 P16050 3/20 0.37
ALDH1A1 P00352 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
GRM8 O00222 2/20 0.37
GRM6 O15303 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GRM2 Q14416 4/20 0.34
GRM3 Q14832 4/20 0.34
FFAR3 O14843 1/20 0.33
LMNA P02545 1/20 0.32
GRM5 P41594 1/20 0.32
MTOR P42345 1/20 0.32

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
SCHEMBL5697686 0.82 NSD2 (0.39) NSD2GRM4CYP1A2CYP2C19ALOX15
SCHEMBL11642738 0.82 CYP2C19 (0.39) NSD2GRM4CYP1A2CYP2C19ALOX15
SCHEMBL25660654 0.75 NSD2 (0.46) NSD2GRM4CYP1A2CYP2C19ALOX15
SCHEMBL21627975 0.74 FFAR3 (0.35) FFAR3
SCHEMBL25660706 0.73 NSD2 (0.44) NSD2GRM4CYP1A2CYP2C19ALOX15
SCHEMBL289295 0.71
SCHEMBL1311182 0.70 NSD2 (0.41) NSD2GRM4CYP1A2CYP2C19ALOX15
SCHEMBL28344677 0.67 NSD2 (0.48) NSD2GRM4CYP1A2CYP2C19ALOX15
SCHEMBL15846730 0.67
SCHEMBL14988089 0.67 FFAR3 (0.33) FFAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118384878-A Ag@HCS@TiO2Preparation method and application of composite photocatalytic material 南通大学 2024-07-26 CN claimed
CN-118122327-A Efficient TiO2@HCS@Cu2Preparation method and application of O composite photocatalyst material 南通大学 2024-06-04 CN claimed
CN-118009492-A Temperature control method and device of pipeline type split air conditioner and intelligent air conditioner 青岛海尔空调器有限总公司 2024-05-10 CN claimed
CN-116011369-A Parameter extraction method of InP HEMT nonlinear equivalent circuit model 华东师范大学 2023-04-25 CN claimed
CN-115358093-B Method for monitoring cracks of main beam of bridge crane in real time 河南卫华重型机械股份有限公司 2023-02-28 CN claimed
CN-115358093-A Method for monitoring cracks of main beam of bridge crane in real time 河南卫华重型机械股份有限公司 2022-11-18 CN claimed
CN-115108969-A Efficient and migration-resistant antioxidant as well as preparation method and application thereof 华南理工大学 2022-09-27 CN claimed
CN-114552692-A Energy supply device and system comprising same 罗伯特·博世有限公司 2022-05-27 CN claimed
EP-4702000-A1 ALKYLATION PROCESS University of Liverpool (GB) 2026-03-04 EP disclosed
WO-2025235719-A1 DIMERIC SMAC MIMETICS USEFUL IN HIV THERAPY VIIV HEALTHCARE COMPANY (US) 2025-11-13 WO disclosed
WO-2025090391-A1 ULTRASONIC SENSING FOR MEASURING OBJECTS IN SPATIAL ENVIRONMENTS PROVIDENTIAL INNOVATIONS, LLC (US) 2025-05-01 WO disclosed
US-20250138173-A1 ULTRASONIC SENSING FOR MEASURING OBJECTS IN SPATIAL ENVIRONMENTS PROVIDENTIAL INNOVATIONS, LLC 2025-05-01 US disclosed
WO-2025031914-A1 DUAL-FLUORESCENCE DYE COMPOUNDS BASED ON 2 CHROMOPHORES COVALENTLY BONDED TO ONE ANOTHER UNIVERSITÄT ZU KÖLN (DE) 2025-02-13 WO disclosed
EP-3595697-B1 CLEAVABLE ESTERS FOR NANOCARRIER-BASED CANCER THERAPY CHILDRENS HOSPITAL PHILADELPHIA (US) 2025-02-12 EP disclosed
US-20060110784-A1 Site-specific labeling of proteins for NMR studies THE SCRIPPS RESEARCH INSTITUTE (US) 2006-05-25 US disclosed
EP-1204639-B1 SYNTHESIS OF A NOVEL PARAMAGNETIC AMINO ACID DERIVATIVE (EPM-5) FOR LABELLING CHEMICAL AND BIOLOGICAL MACROMOLECULES CONSELHO NACIONAL CNPQ (BR) 2005-01-12 EP disclosed
US-6797829-B1 Synthesis of a novel paramagnetic amino derivative (epm-5) for labelling chemical and biological macromolecules CONSELHO NACIONAL DE DESENVOLVIMENTO CIENTIFICO E TECNOLOGICO CNPQ (BR) 2004-09-28 US disclosed
EP-1204639-A4 SYNTHESIS OF A NOVEL PARAMAGNETIC AMINO ACID DERIVATIVE (EPM-5) FOR LABELLING CHEMICAL AND BIOLOGICAL MACROMOLECULES CONSELHO NACIONAL CNPQ (BR) 2003-02-26 EP disclosed
EP-1204639-A1 SYNTHESIS OF A NOVEL PARAMAGNETIC AMINO ACID DERIVATIVE (EPM-5) FOR LABELLING CHEMICAL AND BIOLOGICAL MACROMOLECULES Conselho Nacional de Desenvolvimento Cientifico e Tecnologico - CNPQ (BR) 2002-05-15 EP disclosed
WO-2000078715-A1 SYNTHESIS OF A NOVEL PARAMAGNETIC AMINO ACID DERIVATIVE (EPM-5) FOR LABELLING CHEMICAL AND BIOLOGICAL MACROMOLECULES CONSELHO NACIONAL DE DESENVOLVIMENTO CIENTÍFICO E TECNOLÓGICO - CNPQ (BR) 2000-12-28 WO disclosed