Cyclohexanone

Cyclohexanone

SCHEMBL2897803

O=C1CCCCC1.[NaH]

nearest known ligand 0.00

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⚠ 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
Cycloheptanone SCHEMBL3114931 1.00
Cyclooctanone SCHEMBL3115441 1.00 TRIM24 (0.92)
Cyclohexanone SCHEMBL713141 0.96
SCHEMBL7823646 0.96 TRIM24 (1.00)
Cyclohexanone SCHEMBL386409 0.96 TRIM24 (1.00)
SCHEMBL25380098 0.96 TRIM24 (1.00)
SCHEMBL21403465 0.96 TRIM24 (1.00)
Cyclohexanone SCHEMBL3299 0.96
SCHEMBL112034 0.96 TRIM24 (1.00)
Cycloheptanone SCHEMBL6077 0.96

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6962983-B2 Process for the preparation of diazomethane PHOENIX CHEMICALS LIMITED (GB) 2005-11-08 US claimed
EP-1240134-B1 PROCESS FOR THE PREPARATION OF DIAZOMETHANE PHOENIX CHEMICALS LTD (GB) 2005-02-23 EP claimed
US-20020188112-A1 Process for the preparation of diazomethane PHOENIX CHEMICALS LIMITED (GB) 2002-12-12 US claimed
EP-1240134-A1 PROCESS FOR THE PREPARATION OF DIAZOMETHANE Phoenix Chemicals Limited (GB) 2002-09-18 EP claimed
WO-2001047869-A1 PROCESS FOR THE PREPARATION OF DIAZOMETHANE PHOENIX CHEMICALS LIMITED (GB) 2001-07-05 WO claimed
US-20240174701-A1 ORGANOHALOGEN COMPOUND HAVING CONJUGATED DOUBLE BOND, PROCESS FOR PREPARING ACETATE COMPOUND AND ALCOHOL COMPOUND THEREOF, AND COMPOUND USED TO SYNTHESIZE THE ORGANOHALOGEN COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 2024-05-30 US disclosed
EP-4365159-A1 ORGANOHALOGEN COMPOUND HAVING CONJUGATED DOUBLE BOND, PROCESS FOR PREPARING ACETATE COMPOUND AND ALCOHOL COMPOUND THEREOF, AND COMPOUND USED TO SYNTHESIZE THE ORGANOHALOGEN COMPOUND Shin-Etsu Chemical Co., Ltd. (JP) 2024-05-08 EP disclosed
CN-117924017-A Organic halogen compound having conjugated double bond, method for preparing acetate and alcohol derivative thereof, and compound for synthesizing the compound 信越化学工业株式会社 2024-04-26 CN disclosed
EP-4326412-A1 EXTRACTION METHOD BASF SE (DE) 2024-02-28 EP disclosed
US-10774024-B2 Process for preparing an unsaturated carboxylic acid salt BASF SE (DE) 2020-09-15 US disclosed
EP-3442939-B1 PROCESS FOR PREPARING AN UNSATURATED CARBOXYLIC ACID SALT BASF SE (DE) 2020-08-26 EP disclosed
US-20190112251-A1 PROCESS FOR PREPARING AN UNSATURATED CARBOXYLIC ACID SALT BASF SE (DE) 2019-04-18 US disclosed
EP-1261327-A2 ADENOSINE RECEPTOR MODULATORS F.HOFFMANN-LA ROCHE AG (CH) 2002-12-04 EP disclosed
US-20010027196-A1 Adenosine receptor ligands and their use in the treatment of disease F. HOFFMANN-LA ROCHE AG (CH) 2001-10-04 US disclosed
WO-2001062233-A2 ADENOSINE RECEPTOR MODULATORS F. HOFFMANN LA ROCHE AG (CH) 2001-08-30 WO disclosed
US-5672763-A Process for the preparation of 2-substituted cyclopentanones BAYER AKTIENGESELLSCHAFT (DE) 1997-09-30 US disclosed
US-5488122-A Alkyl substituted metal alkylalkoxyhydroborate reducing agents, and processes for production and use of the same COMPLEX CHEMICALS, CORP. (US) 1996-01-30 US disclosed
US-4118507-A Benzodioxincarboxamide lipogenesis inhibitors SHELL OIL COMPANY (US) 1978-10-03 US disclosed
US-4082810-A STEREOSELECTIVE HYDROGENATING AGENTS ALDRICH-BORANES, INC. (US) 1978-04-04 US disclosed
US-4042585-A Process for preparation of 3-halomethylcephems ELI LILLY AND COMPANY (US) 1977-08-16 US disclosed