SCHEMBL4940644

SCHEMBL4940644

[N-]=[N+]=C1CC=CC=C1C(=O)O

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
Sulfurous Acid SCHEMBL9418895 0.93
SCHEMBL11571800 0.83
SCHEMBL10945743 0.81 ALDH1A1 (0.41)
SCHEMBL4159019 0.75
SCHEMBL44788 0.71 MAOA (0.32)
SCHEMBL10544273 0.69 KMT2A (0.36)
SCHEMBL11346988 0.69
SCHEMBL9619936 0.69
SCHEMBL262994 0.69 PYGM (0.35)
SCHEMBL16062024 0.69 KDM4E (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113279139-B Preparation method of high-strength fluffy melt-blown fabric 杭州诗蓝过滤科技有限公司 2022-06-17 CN claimed
CN-113279139-A Preparation method of high-strength fluffy melt-blown fabric 杭州诗蓝过滤科技有限公司 2021-08-20 CN claimed
CN-112321852-A High-strength graphene-polyacrylic acid composite conductive hydrogel and preparation method thereof 广州晖晴信息科技有限公司 2021-02-05 CN disclosed
EP-1994101-A2 FORMATION OF ORGANIC ELECTRO-GRAFTED FILMS ON THE SURFACE OF ELECTRICALLY CONDUCTIVE OR SEMI-CONDUCTIVE SURFACES Alchimer (FR) 2008-11-26 EP disclosed
US-20080262139-A1 Flame retardant crosslink agent and epoxy resin compositions free of halogen and phosphorous INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE 2008-10-23 US disclosed
EP-1906958-A2 PYRAZOLO[3,4-B]PYRIDIN-2-YL]-BENZOIC ACID DERIVATIVES AS HIV INTEGRASE INHIBITORS Ambrilia Biopharma Inc. (CA) 2008-04-09 EP disclosed
WO-2007099137-A2 FORMATION OF ORGANIC ELECTRO-GRAFTED FILMS ON THE SURFACE OF ELECTRICALLY CONDUCTIVE OR SEMI-CONDUCTIVE SURFACES ALCHIMER (FR) 2007-09-07 WO disclosed
WO-2007000043-A2 PYRAZOLO[3,4-B]PYRIDIN-2-YL]-BENZOIC ACID DERIVATIVES AS HIV INTEGRASE INHIBITORS AMBRILIA BIOPHARMA INC. (CA) 2007-01-04 WO disclosed
US-20040087436-A1 Novel polymerisation catalysts BP CHEMICALS LIMITED (GB) 2004-05-06 US disclosed
EP-1362068-A2 NOVEL POLYMERISATION CATALYSTS BP Chemicals Limited (GB) 2003-11-19 EP disclosed
WO-2002050138-A2 NOVEL POLYMERISATION CATALYSTS BP CHEMICALS LIMITED (GB) 2002-06-27 WO disclosed
EP-0249613-A1 MAMMALIAN INTERLEUKIN-4. SCHERING BIOTECH CORP (US) 1987-12-23 EP disclosed
US-4714683-A IMMUNOASSAY, MEDICAL DIAGNOSIS ONCOGEN (US) 1987-12-22 US disclosed
EP-0230107-A1 Mammalian interleukin-4 Schering Biotech Corporation (US) 1987-07-29 EP disclosed
WO-1987002990-A1 MAMMALIAN INTERLEUKIN-4 SCHERING-BIOTECH CORPORATION (US) 1987-05-21 WO disclosed
EP-0210233-A1 BRAIN DERIVABLE POLYPEPTIDE FACTORS AND ANTIBODIES ONCOGEN (US) 1987-02-04 EP disclosed
WO-1986004239-A1 BRAIN DERIVABLE POLYPEPTIDE FACTORS AND ANTIBODIES ONCOGEN (US) 1986-07-31 WO disclosed
US-4572901-A BINDING AN ANALYTE TO SOLID SUPPORT USING AN ALKYLATED POLYAMINO ACID CHILDREN'S HOSPITAL MEDICAL CENTER OF NORTHERN CALIFORNIA (US) 1986-02-25 US disclosed
US-4076721-A FROM PHOSGENE AND POTASSIUM OR CALCIUM METHYL BENZOATE-O-SULFONATE, AMMONIA, DMF IHARA CHEMICAL INDUSTRY CO., LTD. (JA) 1978-02-28 US disclosed
US-4057555-A FROM PHOSGENE AND O-SULFOBENZOIC ACID, DIMETHYLFORMAMIDE, ALCOHOL, AMMONIA IHARA CHEMICAL INDUSTRY CO., LTD. (JA) 1977-11-08 US disclosed