SCHEMBL580646

SCHEMBL580646

C1=C\C=C/[N]C\C=C/1

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
SCHEMBL10872085 1.00
SCHEMBL20598 0.97
SCHEMBL668009 0.65
SCHEMBL2719164 0.65
SCHEMBL76038 0.65
SCHEMBL478038 0.64
SCHEMBL2498181 0.62
SCHEMBL5695369 0.61
SCHEMBL426355 0.60
SCHEMBL28908116 0.60

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0163537-A1 1-Propanone derivatives and pharmaceutical compositions containing same TOKYO TANABE COMPANY LIMITED (JP) 1985-12-04 EP claimed
CN-115703802-A Boron-containing organic compound and application thereof 北京鼎材科技有限公司 2023-02-17 CN disclosed
CN-115304627-A Polar boron-nitrogen luminescent material, application thereof and organic electroluminescent device comprising same 清华大学 2022-11-08 CN disclosed
CN-115010736-A Polar boron-nitrogen luminescent material, application thereof and organic electroluminescent device comprising same 清华大学 2022-09-06 CN disclosed
CN-114773210-A Organic compound and application thereof 北京鼎材科技有限公司 2022-07-22 CN disclosed
CN-113260602-A Process for producing fluoroalcohol salt 大金工业株式会社 2021-08-13 CN disclosed
CN-112047913-A Fluorine-containing complex compound and method for producing fluorine-containing organic compound using same 大金工业株式会社 2020-12-08 CN disclosed
CN-112020485-A Method for producing difluoromethylene compound 大金工业株式会社 2020-12-01 CN disclosed
CN-111961068-A Fluorine-containing complex compound and method for producing fluorine-containing organic compound using same 大金工业株式会社 2020-11-20 CN disclosed
EP-2417112-A1 SULFONIC AMIDE AND SULFOXIMINE-SUBSTITUTED DIARYL-DIHYDROPYRIMIDINONES AND USAGE THEREOF Bayer Pharma Aktiengesellschaft (DE) 2012-02-15 EP disclosed
WO-2010115548-A1 SULFONIC AMIDE AND SULFOXIMINE-SUBSTITUTED DIARYL-DIHYDROPYRIMIDINONES AND USAGE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-10-14 WO disclosed
EP-1216256-A1 MACROLIDE ANTIBIOTICS AND TREATMENT OF PASTEURELLOSIS ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 2002-06-26 EP disclosed
WO-2001016148-A1 MACROLIDE ANTIBIOTICS AND TREATMENT OF PASTEURELLOSIS ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 2001-03-08 WO disclosed
EP-0768303-A1 OPTICALLY ACTIVE QUINOLINECARBOXYLIC ACID DERIVATIVE AND PROCESS FOR PRODUCING THE SAME NIPPON SHINYAKU COMPANY, LIMITED (JP) 1997-04-16 EP disclosed
EP-0369810-A2 PAF antagonists as anti-hyperendothelinemia agents Takeda Chemical Industries, Ltd. (JP) 1990-05-23 EP disclosed