SCHEMBL304991

SCHEMBL304991

CC(=O)CCC#N

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Water SCHEMBL17727821 1.00
SCHEMBL28247208 0.97
SCHEMBL329262 0.83
SCHEMBL7779358 0.81
SCHEMBL11407276 0.81 CHRM1 (0.50)
Ethylene SCHEMBL8561240 0.79 ALDH1A1 (0.41)
SCHEMBL17260760 0.79 PAOX (0.50)
SCHEMBL9355012 0.79 PAOX (0.50)
SCHEMBL9464575 0.79 KDM4E (0.50)
SCHEMBL10370310 0.79 PAOX (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118164552-A Battery anode material and preparation method thereof 合肥国轩高科动力能源有限公司 2024-06-11 CN claimed
CN-113501770-B Acetonitrile refining method 中国天辰工程有限公司 2024-01-16 CN claimed
CN-116448927-B Method for detecting organic chlorine pesticide residues in astragalus 广东维安检测科技有限公司 2023-10-10 CN claimed
CN-116622064-A Aptamer-molecular imprinting fluorescence covalent organic framework sensor for measuring diethylstilbestrol and preparation and application thereof 江南大学 2023-08-22 CN claimed
CN-116448927-A Method for detecting organic chlorine pesticide residues in astragalus 广东维安检测科技有限公司 2023-07-18 CN claimed
CN-116162116-A Method for extracting amygdalin, amygdalin protein and amygdalin total flavone from amygdalin debitterizing solution 陕西嘉禾生物科技股份有限公司 2023-05-26 CN claimed
CN-115011660-B Metabolism promoting and oxidation resisting oat protein peptide and preparation method and application thereof 北京幸福能量健康科技有限公司 2022-10-28 CN claimed
CN-113588618-B Preparation method and application of up-conversion luminescence flexible biosensor for diethylstilbestrol detection 江苏大学 2022-10-28 CN claimed
CN-115112806-A Method for determining hexavalent chromium in food 山东安谱检测科技有限公司 2022-09-27 CN claimed
CN-115011660-A Metabolism promoting and oxidation resisting oat protein peptide and preparation method and application thereof 北京幸福能量健康科技有限公司 2022-09-06 CN claimed
EP-1608634-A4 METHODS FOR ISOLATING CRYSTALLINE FORM I OF 5-AZACYTIDINE PHARMION CORP (US) 2006-03-15 EP claimed
US-20060047108-A1 Synthesis of idarubicin aglycone SICOR, INC. 2006-03-02 US claimed
WO-2006024016-A2 SYNTHESIS OF IDARUBIN AGLYCONE SICOR, INC. (US) 2006-03-02 WO claimed
EP-1608634-A2 METHODS FOR ISOLATING CRYSTALLINE FORM I OF 5-AZACYTIDINE Pharmion Corporation (US) 2005-12-28 EP claimed
WO-2004082822-A2 METHODS FOR ISOLATING CRYSTALLINE FORM I OF 5-AZACYTIDINE PHARMION CORPORATION (US) 2004-09-30 WO claimed
US-20030176540-A1 Novel synergistic solid/semi-solid organic composition, a process of preparing such organic composition and a method of altering physical properties of liquid neutral organic compounds and their mixtures NAGARJUNA HOLDING PRIVATE LIMITED (IN) 2003-09-18 US claimed
EP-1255450-A1 NOVEL SYNERGISTIC SOLID/SEMI-SOLID ORGANIC COMPOSITION AND A PROCESS OF PREPARING SUCH A COMPOSITION Nagarjuna Holdings Private Limited (IN) 2002-11-13 EP claimed
WO-2001056396-A1 NOVEL SYNERGISTIC SOLID/SEMI-SOLID ORGANIC COMPOSITION AND A PROCESS OF PREPARING SUCH A COMPOSITION NAGARJUNA HOLDINGS PRIVATE LIMITED (IN) 2001-08-09 WO claimed
US-5539087-A RECOVERING ANTIBIOTICS BY EXTRACTION OF BROTHS WITH CATIONIC SURFACTANTS AND SOLVENTS GRUPPO LEPETIT SPA (IT) 1996-07-23 US claimed
EP-0214941-A2 Method for the removal of the formyl group from an ester of an N-formyl peptide or N-formyl aminoacid LARK S.p.A. (IT) 1987-03-18 EP claimed