SCHEMBL870972

SCHEMBL870972

C1=CC2=NCCN2C=C1

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
SCHEMBL5429782 0.87 KDM4E (0.44)
SCHEMBL5748917 0.70 KDM4E (0.44)
SCHEMBL6850246 0.68 KDM4E (0.36)
SCHEMBL2162391 0.68 ALDH1A1 (0.36)
SCHEMBL6850184 0.68 KDM4E (0.47)
SCHEMBL20049146 0.68 KDM4E (0.51)
SCHEMBL624186 0.66 ALDH1A1 (0.39)
SCHEMBL16368585 0.65 KDM4E (0.31)
SCHEMBL15057332 0.64
SCHEMBL11683434 0.62 NOS3 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4143142-A NOVEL PYRIDO-IMIDAZO-INDOLES, COMPOSITIONS AND METHOD THEREWITH ADHIKARY PARIMAL K 1979-03-06 US claimed
CN-122079815-A Mitochondrial complex III inhibitor compound containing azo structure, preparation method thereof and agricultural sterilization application 2026-05-26 CN disclosed
CN-119504753-A Aromatic condensed ring imine compound, and preparation method and application thereof 华东理工大学 2025-02-25 CN disclosed
CN-115340495-B O-nitrobenzene compound and preparation method and application thereof 华东理工大学 2024-12-03 CN disclosed
CN-107629022-B Antibacterial synergist and preparation method and application thereof 上海医药工业研究院 2024-11-12 CN disclosed
US-20240360156-A1 HETEROCYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-10-31 US disclosed
CN-111087345-B Azobenzene heterocyclic amide derivative, and preparation method and application thereof 华东理工大学 2024-10-15 CN disclosed
CN-113150053-B Azobenzene avermectin derivative and preparation method and application thereof 华东理工大学 2024-10-01 CN disclosed
CN-114105986-B Aromatic condensed ring diketone compound and preparation method and application thereof 华东理工大学 2024-09-27 CN disclosed
WO-2024179532-A1 ANTIBACTERIAL AND SYNERGISTIC ACTIVE COMPOUND AND USE THEREOF 华东理工大学 2024-09-06 WO disclosed
EP-1311508-A2 NOVEL BETA-AMYLOID INHIBITORS, METHOD FOR PRODUCING THE SAME AND THE USE THEREOF AS MEDICAMENTS Boehringer Ingelheim Pharma KG (DE) 2003-05-21 EP disclosed
US-6514969-B2 Alzheimer's diseas, Parkinson disease, Huntington disease BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-02-04 US disclosed
US-20020042420-A1 Beta-amyloid inhibitors, processes for preparing them, and their use in pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-04-11 US disclosed
WO-2002014313-A2 NOVEL BETA-AMYLOID INHIBITORS, METHOD FOR PRODUCING THE SAME AND THE USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-02-21 WO disclosed
US-4163745-A ANTIDIABETIC, HYPOGLYCEMIC PFIZER INC. (US) 1979-08-07 US disclosed
US-4141898-A Imidazo pyridinium quaternary salts as hypoglycemic agents PFIZER INC. (US) 1979-02-27 US disclosed
US-4129567-A IMIDAZOPYRIDINES AND ISOB IDINE PFIZER INC. (US) 1978-12-12 US disclosed
US-4097598-A Quaternary salts as hypoglycemic agents PFIZER INC. (US) 1978-06-27 US disclosed
US-4093616-A PYRROLO(1,2-A)PYRAZINIUM, PYRAZOLO(1,5-A)PYRIDINIUM, 1H-IMIDAZO(2,1-A)ISOQUINOLINIUM, OR IMIDAZO(5,1-A)ISOQUINOLINIUM SALTS PFIZER INC. (US) 1978-06-06 US disclosed
US-4044015-A Imidazopyridinium compounds as hypoglycemic agents PFIZER INC. (US) 1977-08-23 US disclosed