SCHEMBL872395

SCHEMBL872395

CC1(N)C=CC=CN1

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
Nonane SCHEMBL28055259 0.85 TSHR (0.32)
Trifluoroacetic Acid SCHEMBL28136603 0.80 F2 (0.30)
SCHEMBL2705118 0.71
SCHEMBL27570510 0.69
SCHEMBL8052178 0.67
SCHEMBL6510676 0.67
SCHEMBL696287 0.67
SCHEMBL2991159 0.67
SCHEMBL3442717 0.67
SCHEMBL5919651 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113195644-A Coating against a substrate by in situ polymerization 汉高股份有限及两合公司 2021-07-30 CN claimed
CN-109923114-A Pyrazolopyridine derivatives as HPK1 modulators and their use for the treatment of cancer 因赛特公司 2019-06-21 CN claimed
CN-105452233-B Piperidine and azepane derivatives as prokineticin receptor modulators 武田药品工业株式会社 2017-12-08 CN claimed
CN-118382730-A Electrolyte medium for electropolishing and method for electropolishing using the same 德里莱特公司 2024-07-23 CN disclosed
CN-116519853-A Method for rapidly detecting fatty acid derivatives in dairy products 江南大学 2023-08-01 CN disclosed
CN-115043836-B P2X3 receptor selective modulator of imidazopyridine derivative and pharmaceutical application thereof 苏州璞正医药有限公司 2023-07-18 CN disclosed
CN-113195644-B Coating against a substrate by in situ polymerization 汉高股份有限及两合公司 2023-01-24 CN disclosed
WO-2022036208-A1 ANTIBACTERIAL ADJUVANTS AND APPLICATIONS THEREOF THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2022-02-17 WO disclosed
CN-113260623-A Manganese catalysts and their use in the hydrogenation of ketones 圣安德鲁斯大学董事会 2021-08-13 CN disclosed
CN-113195644-A Coating against a substrate by in situ polymerization 汉高股份有限及两合公司 2021-07-30 CN disclosed
CN-112204697-A Structure verification of very long chain dicarboxylic acids 林肯纪念大学 2021-01-08 CN disclosed
WO-2012037928-A2 COMPOUNDS FOR THE DIAGNOSIS OF NEURODEGENERATIVE DISORDERS ON THE OLFACTORY EPITHELIUM KLINIKUM DARMSTADT GMBH (DE) 2012-03-29 WO disclosed
CN-102171213-A Pyrazolo [3, 4] pyrimidin-4-yl derivatives and their uses to treat diabetes and obesity ASTRAZENECA AB 2011-08-31 CN disclosed
CN-102143957-A Benzimidazoles and related analogs as sirtuin modulators SIRTRIS PHARMACEUTICALS INC 2011-08-03 CN disclosed
CN-101952284-A Novel tetracyclic compounds MEDIVATION TECHNOLOGIES INC 2011-01-19 CN disclosed
CN-1926108-B Non-nucleotide reverse transcriptase inhibitors MEDIVIR AB 2010-06-09 CN disclosed
CN-1926108-A Non-nucleotide reverse transcriptase inhibitors MEDIVIR AB (SE) 2007-03-07 CN disclosed
US-6767571-B2 HEAT TREATING FUNGUS WITH WATER TO REDUCE NUCLEIC ACID CONTENT AND CONCENTRATING SOLIDS, THEN REACTING SOLIDS WITH CYSTEINE, HYDROGEN SULFIDE, OR AMMONIUM SULFIDE; REPLACEMENTS FOR HYDROLYSED VEGETABLE PROTEINS, YEAST AUTOLYSATES/EXTRACTS ZENECA LIMITED (GB) 2004-07-27 US disclosed
US-6579553-B1 Reaction product cysteine, hydrogen sulfide, ammonium sulfide and extracellular liquid fusarium extracts used as food flavors ZENECA LIMITED (GB) 2003-06-17 US disclosed
US-5522996-A CONTACTING WITH TRIS/PYRIDYLALKYL/AMINE LIGAND, REMOVING FORMED COMPLEX NATIONAL RESEARCH COUNCIL OF CANADA (CA) 1996-06-04 US disclosed