SCHEMBL788181

SCHEMBL788181

O=C1CCCC[C@@H]1O

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
SCHEMBL222046 1.00
SCHEMBL5063975 1.00
SCHEMBL2864371 0.97 KMT2A (0.52)
SCHEMBL2195150 0.97 KMT2A (0.52)
SCHEMBL2196254 0.97 KMT2A (0.52)
SCHEMBL2196978 0.97 KMT2A (0.52)
SCHEMBL2197061 0.97 KMT2A (0.52)
SCHEMBL2196708 0.97 KMT2A (0.52)
SCHEMBL5374326 0.97 KMT2A (0.52)
SCHEMBL16334939 0.97

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8884067-B2 Phenol and cyclohexanone mixtures EXXONMOBIL CHEMICAL PATENTS INC. (US) 2014-11-11 US claimed
US-20130225867-A1 Phenol and Cyclohexanone Mixtures EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-08-29 US claimed
WO-2012036822-A1 PHENOL AND CYCLOHEXANONE MIXTURES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-22 WO claimed
CN-120210143-B (2R, 3R) -butanediol dehydrogenase mutant and application thereof in preparation of (2S) -hydroxycyclohexanone 浙江大学 2025-08-22 CN disclosed
CN-120210143-B (2R, 3R) -butanediol dehydrogenase mutant and application thereof in preparation of (2S) -hydroxycyclohexanone 浙江大学 2025-08-22 CN disclosed
CN-120210143-A (2R, 3R) -butanediol dehydrogenase mutant and application thereof in preparation of (2S) -hydroxycyclohexanone 浙江大学 2025-06-27 CN disclosed
CN-120210143-A (2R, 3R) -butanediol dehydrogenase mutant and application thereof in preparation of (2S) -hydroxycyclohexanone 浙江大学 2025-06-27 CN disclosed
US-10906033-B2 Synthesis and application of chiral substituted polyvinylpyrrolidinones KANSAS STATE UNIVERSITY RESEARCH FOUNDATION (US) 2021-02-02 US disclosed
US-10570079-B2 Cyclohexanone compositions and processes for making such compositions EXXONMOBIL CHEMICAL PATENTS INC. (US) 2020-02-25 US disclosed
EP-3180304-B1 PROCESS FOR PRODUCING CYCLOHEXANONE EXXONMOBIL CHEMICAL PATENTS INC (US) 2019-10-30 EP disclosed
US-20190185403-A1 Cyclohexanone Compositions and Processes for Making Such Compositions EXXONMOBIL CHEMICAL PATENTS INC. 2019-06-20 US disclosed
WO-2012036826-A2 PROCESSES FOR PRODUCING PHENOL EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-22 WO disclosed
WO-2012036827-A1 PROCESSES FOR PRODUCING PHENOL EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-22 WO disclosed
WO-2012036822-A1 PHENOL AND CYCLOHEXANONE MIXTURES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-22 WO disclosed
US-7872123-B2 Process of making α-aminooxyketone/α-aminooxyaldehyde and α-hydroxyketone/α-hydroxyaldehyde compounds and a process making reaction products from cyclic α,β-unsaturated ketone substrates and nitroso substrates JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2011-01-18 US disclosed
US-20100152464-A1 SYNTHETIC PROCESS FOR AMINOCYCLOHEXYL ETHER COMPOUNDS CARDIOME PHARMA CORP. (CA) 2010-06-17 US disclosed
US-20100099915-A1 PROCESS OF MAKING ALPHA-AMINOOXYKETONE/ALPHA-AMINOOXYALDEHYDE AND ALPHA-HYDROXYKETONE/ALPHA-HYDROXYALDEHYDE COMPOUNDS AND A PROCESS MAKING REACTION PRODUCTS FROM CYCLIC ALPHA, BETA-UNSATURATED KETONE SUBSTRATES AND NITROSO SUBSTRATES JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2010-04-22 US disclosed
US-20070254945-A1 AMINOCYCLOHEXYL ETHER COMPOUNDS AND USES THEREOF CARDIOME PHARMA CORP. (CA) 2007-11-01 US disclosed
US-20070099983-A1 Aminocyclohexyl ether compounds and uses thereof CARDIOME PHARMA CORP. (CA) 2007-05-03 US disclosed
US-20070037973-A1 reacting a cyclic alpha , beta -unsaturated ketone compound with a nitroso compound in the presence of a proline-based catalyst to provide 7-Phenyl-6-oxa-7-aza-bicyclo[3.2.2]nonan-9-one or derivatives; catalytic asymmetric O-nitroso Aldol/Michael reaction JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2007-02-15 US disclosed