SCHEMBL1021476

SCHEMBL1021476

CN(C)C=CN

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
SCHEMBL757803 1.00
SCHEMBL8245488 1.00
SCHEMBL14385620 0.72
SCHEMBL185083 0.71
SCHEMBL413517 0.71
SCHEMBL15372069 0.71
SCHEMBL6862328 0.67
SCHEMBL20128403 0.65
SCHEMBL15047178 0.65
SCHEMBL18391885 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11198666-B2 Method for preparing (meth)acrylic acid ester based compound LG CHEM, LTD. 2021-12-14 US claimed
EP-3778546-B1 METHOD FOR PREPARING (METH)ACRYLIC ACID ESTER-BASED COMPOUND LG CHEMICAL LTD (KR) 2021-11-24 EP claimed
US-20210130279-A1 A Method For Preparing (Meth)Acrylic Acid Ester Based Compound LG CHEM, LTD. (KR) 2021-05-06 US claimed
EP-3778546-A1 METHOD FOR PREPARING (METH)ACRYLIC ACID ESTER-BASED COMPOUND LG Chem, Ltd. (KR) 2021-02-17 EP claimed
WO-2020226271-A1 METHOD FOR PREPARING (METH)ACRYLIC ACID ESTER-BASED COMPOUND 주식회사 엘지화학 2020-11-12 WO claimed
EP-2200980-B9 AMINO ARYLSULFONAMIDE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS FIELD OF INVENTION SUVEN LIFE SCIENCES LTD (IN) 2011-12-28 EP claimed
EP-2200980-B1 AMINO ARYLSULFONAMIDE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS FIELD OF INVENTION SUVEN LIFE SCIENCES LTD (IN) 2011-08-03 EP claimed
EP-2094677-B1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO-DEGENERATIVE DISEASES REMYND NV (BE) 2011-01-12 EP claimed
CN-118302407-A Carbonyl compound, method for producing isocyanate compound, and isocyanate composition 旭化成株式会社 2024-07-05 CN disclosed
CN-118215651-A Method for producing isocyanate compound, method for producing urethane compound, method for recovering amine compound, and isocyanate composition 旭化成株式会社 2024-06-18 CN disclosed
US-20230381323-A1 RELEASABLE CONJUGATES FISH & RICHARDSON PC 2023-11-30 US disclosed
US-11786599-B2 Releasable conjugates QUIAPEG PHARMACEUTICALS AB (SE) 2023-10-17 US disclosed
EP-4186888-A1 COMPOUND AND COMPOSITIONS FOR INTRACELLULAR DELIVERY OF THERAPEUTIC AGENTS ModernaTX, Inc. (US) 2023-05-31 EP disclosed
WO-2023080257-A1 METHOD FOR PRODUCING ISOCYANATE COMPOUNDS, METHOD FOR PRODUCING CARBAMATE COMPOUNDS, METHOD FOR RECOVERING AMINE COMPOUNDS, AND ISOCYANATE COMPOSITION 旭化成株式会社 2023-05-11 WO disclosed
WO-2004013153-A2 MACROLIDE COMPOUNDS ENDOWED WITH ANTIINFLAMMATORY ACTIVITY ZAMBON GROUP S.P.A. (IT) 2004-02-12 WO disclosed
CN-1417244-A Preparation process of soft foamed polyurethane TOSO KK (JP) 2003-05-14 CN disclosed
US-4873251-A MUSCLE RELAXANTS, ANTICONVULSANTS, ANTIANXIETY AGENTS A. H. ROBINS COMPANY, INCORPORATED (US) 1989-10-10 US disclosed
EP-0127771-A2 Quarternary amine carbamate or urea compounds based on isopropenyl-, alpha, alpha-dimethylbenzyl isocyanate AMERICAN CYANAMID COMPANY (US) 1984-12-12 EP disclosed
US-4429096-A Quaternary amine carbamate or urea compounds based on isopropenyl-α,α-dimethylbenzyl isocyanate AMERICAN CYANAMID COMPANY (US) 1984-01-31 US disclosed
US-4255450-A Use of aminohydroxy acid amides as antimicrobial substances HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 1981-03-10 US disclosed