SCHEMBL3869809

SCHEMBL3869809

CC1([N+](=O)[O-])C=CC=C([N+](=O)[O-])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
SCHEMBL27955455 0.79
SCHEMBL28628914 0.78
SCHEMBL5378262 0.78
SCHEMBL5025202 0.78
SCHEMBL2024521 0.74
SCHEMBL27695099 0.74
SCHEMBL6130810 0.74
SCHEMBL28550944 0.74 PKM (0.31)
SCHEMBL29105246 0.74 TP53 (0.31)
SCHEMBL27600827 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114907561-A Method for synthesizing photodegradable polyketone, catalyst used by method and preparation method of catalyst 中国石油天然气股份有限公司 2022-08-16 CN claimed
CN-108586504-B Synthesis method and use method of terbium complex with fluorescent colorimetric sensing performance 河南理工大学 2020-12-04 CN claimed
US-20080038832-A1 Method for Producing Molecularly Imprinted Polymers for the Recognition of Target Molecules MIP TECHNOLOGIES AB 2008-02-14 US claimed
EP-1802969-A1 METHOD FOR PRODUCING MOLECULARLY IMPRINTED POLYMERS FOR THE RECOGNITION OF TARGET MOLECULES MIP Technologies AB (SE) 2007-07-04 EP claimed
WO-2006041398-A1 METHOD FOR PRODUCING MOLECULARLY IMPRINTED POLYMERS FOR THE RECOGNITION OF TARGET MOLECULES MIP TECHNOLOGIES AB (SE) 2006-04-20 WO claimed
US-4377699-A REACTING INDOLINE WITH AN ORGANIC CARBOXYLIC ACID ACYLATING AGENT, CHLORINATION, SAPONIFICATION, FOLLOWED BY OXIDATION WITH AN AROMATIC NITRO COMPOUND RUTGERSWERKE AKTIENGESELLSCHAFT (DE) 1983-03-22 US claimed
US-11965068-B2 Cross-linked polymer networks and methods of making and using same CORNELL UNIVERSITY (US) 2024-04-23 US disclosed
CN-117255715-A Catalytic material suitable for hydrogenation reactions comprising Ni, one or more additional metals M and a specific oxidation support material 巴斯夫欧洲公司 2023-12-19 CN disclosed
CN-114907561-A Method for synthesizing photodegradable polyketone, catalyst used by method and preparation method of catalyst 中国石油天然气股份有限公司 2022-08-16 CN disclosed
CN-114797934-A Nitrogen-doped carbon nanotube supported palladium platinum catalyst and preparation method and application thereof 福州大学 2022-07-29 CN disclosed
CN-111044574-B Ultra-sensitive plastic bomb detection sensor 东南大学 2022-03-04 CN disclosed
CN-215876292-U Resource recovery device of o-toluenediamine waste liquid 福州市福化环保科技有限公司 2022-02-22 CN disclosed
CN-108586504-B Synthesis method and use method of terbium complex with fluorescent colorimetric sensing performance 河南理工大学 2020-12-04 CN disclosed
WO-2004106563-A1 PROCESS FOR RECOVERY OF PALLADIUM FROM SPENT CATALYST COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2004-12-09 WO disclosed
US-20040241066-A1 Process for recovery of palladium from spent catalyst COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2004-12-02 US disclosed
US-5895793-A Fluorine-containing hydrocarbon composition ASAHI GLASS COMPANY LTD. (JP) 1999-04-20 US disclosed
US-5789455-A Fluorine-containing hydrocarbon composition ASAHI GLASS COMPANY LTD. (JP) 1998-08-04 US disclosed
US-5714634-A RETAINING A CONCENTRATION OF WATER IN PURIFIED MOLTEN TOLUENEDIAMINE PRODUCT MIXTURE AFTER DISTILLATION, LIQUID PHASE STORAGE AT A CONTROLLED TEMPERATURE BELOW BOILING POINT OF WATER AIR PRODUCTS AND CHEMICALS, INC. (US) 1998-02-03 US disclosed
EP-0566783-A1 Process for the production of nitrodiarylamines AKZO N.V. (NL) 1993-10-27 EP disclosed
US-4158660-A Process for producing a purified 3,4-toluenediamine product and a mixture of 4- and 5-methylbenzotriazoles from a mixture of ortho-toluenediamine isomers OLIN CORPORATION (US) 1979-06-19 US disclosed