Cyclohexanone

Cyclohexanone

SCHEMBL3600071

CC(=O)O.O=C1CCCCC1

nearest known ligand 0.65

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Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Cyclohexanone. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ESR1 known ✓ P03372 1/20 0.31
TRIM24 O15164 2/20 0.65
TRIM33 Q9UPN9 2/20 0.65
ALDH1A1 P00352 1/20 0.65
FFAR3 O14843 1/20 0.41
LCK P06239 1/20 0.41
FYN P06241 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.33
KMT2A Q03164 1/20 0.33
HTT P42858 1/20 0.32
THRB P10828 1/20 0.31
PGR P06401 1/20 0.31
CHRM2 P08172 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
AR P10275 1/20 0.31
CHRM1 P11229 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A3 Q01959 1/20 0.31
MAPK1 P28482 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
Cyclohexanone SCHEMBL28536813 1.00 TRIM24 (0.65) TRIM24TRIM33ALDH1A1FFAR3LCK
Cyclohexanone SCHEMBL9421237 1.00 TRIM24 (0.65) TRIM24TRIM33ALDH1A1FFAR3LCK
Cycloheptanone SCHEMBL3602798 1.00 TRIM24 (0.65) TRIM24TRIM33ALDH1A1FFAR3LCK
Cyclohexanone SCHEMBL28259728 0.97 TRIM24 (0.61) TRIM24TRIM33ALDH1A1FFAR3LCK
Cyclopentanone SCHEMBL3600348 0.97 TRIM24 (0.62) TRIM24TRIM33ALDH1A1FFAR3LCK
Cyclohexanone SCHEMBL2255977 0.95 ALDH1A1 (0.58) TRIM24TRIM33ALDH1A1FFAR3LCK
Cyclohexanone SCHEMBL1071504 0.91 TRIM24 (0.69) TRIM24TRIM33ALDH1A1SMN1; SMN2KMT2A
Cyclohexanone SCHEMBL15659452 0.88 TRIM24 (0.65) TRIM24TRIM33ALDH1A1SMN1; SMN2KMT2A
Cyclohexanone SCHEMBL27491229 0.88 TRIM24 (0.65) TRIM24TRIM33ALDH1A1SMN1; SMN2KMT2A
Cyclopentanone SCHEMBL8150513 0.88 TRIM24 (0.67) TRIM24TRIM33ALDH1A1SMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103869622-B Photosensitive composition for the black matrix in liquid crystal display device, the black matrix with the composition and the method for forming black matrix using the composition 乐金显示有限公司 2019-06-11 CN claimed
CN-108586178-A The manufacturing method of nitrile and its corresponding amine 中国石油化工股份有限公司 2018-09-28 CN claimed
CN-104557610-B Process for the manufacture of nitriles and their corresponding amines 中国石油化工股份有限公司 2018-04-27 CN claimed
CN-105238259-A Vacuum plating UV coating for PET plastic cement DEYANG SENHUA COATING CHEMICAL CO LTD 2016-01-13 CN claimed
EP-0688769-B1 Method of preparation of the 2-coumaranone CLARIANT FRANCE SA (FR) 2000-03-22 EP claimed
US-5616733-A VAPOR PHASE REACTION OF GLYOXYLIC ACID WITH CYCLOHEXANONE IN PRESENCE OF A DEHYDRATION CATALYST SOCIETE FRANCAISE HOECHST (FR) 1997-04-01 US claimed
CN-111349018-B Process for fluorinating inorganic or organic compounds by direct fluorination 福建永晶科技股份有限公司 2024-04-16 CN disclosed
US-11795138-B2 Process of fluorinating inorganic compounds by direct fluorination Fujian Yongjing Technology Co.,Ltd (CN) 2023-10-24 US disclosed
US-20220135516-A1 Process of Fluorinating Inorganic Compounds by Direct Fluorination Fujian Yongjing Technology Co.,Ltd (CN) 2022-05-05 US disclosed
WO-2021031432-A1 PROCESS OF FLUORINATING INORGANIC OR ORGANIC COMPOUNDS BY DIRECT FLUORINATION FUJIAN YONGJING TECHNOLOGY CO., LTD (CN) 2021-02-25 WO disclosed
US-20210053911-A1 Process of Fluorinating Inorganic or Organic Compounds by Direct Fluorination FUJIAN YONGJING TECHNOLOGY CO., LTD (CN) 2021-02-25 US disclosed
EP-3782969-A1 PROCESS OF FLUORINATING INORGANIC OR ORGANIC COMPOUNDS BY DIRECT FLUORINATION Fujian Yongjing Technology Co., Ltd. (CN) 2021-02-24 EP disclosed
CN-111349018-A Process for fluorinating inorganic or organic compounds by direct fluorination 福建永晶科技股份有限公司 2020-06-30 CN disclosed
EP-0551138-B1 Film for a light valve, and method for manufacturing the film HANKUK GLASS IND INC (KR) 1997-04-02 EP disclosed
US-5616733-A VAPOR PHASE REACTION OF GLYOXYLIC ACID WITH CYCLOHEXANONE IN PRESENCE OF A DEHYDRATION CATALYST SOCIETE FRANCAISE HOECHST (FR) 1997-04-01 US disclosed
US-5488601-A Photoelectric sensor, information recording system, and information recording method DAI NIPPON PRINTING CO., LTD. (JP) 1996-01-30 US disclosed
EP-0551138-A1 Film for a light valve, and method for manufacturing the film HANKUK GLASS INDUSTRIES, INC. (KR) 1993-07-14 EP disclosed
EP-0307077-A1 Tetrahydrocarbazoles for the improvement of cyclosporin therapy MERCK FROSST CANADA INC. (CA) 1989-03-15 EP disclosed
EP-0001498-A1 Abrasion resistant coating compositions and substrates and laminates coated therewith MONSANTO COMPANY (US) 1979-04-18 EP disclosed
US-4115622-A POLYVINYL ACETAL RESIN, FLUORINATED ALCOHOL, POLYSILIC ACID MONSANTO COMPANY (US) 1978-09-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11795138-B2 Process of fluorinating inorganic compounds by direct fluorination AFF2, CYP4F2, AFF1 ESR1 1446/4885TRIM24 3607/4885TRIM33 2928/4885
US-20210053911-A1 Process of Fluorinating Inorganic or Organic Compounds by Direct Fluorination CYP4F2, AFF2, CYP4F3 ESR1 1751/4885TRIM24 3323/4885TRIM33 2627/4885
US-20220135516-A1 Process of Fluorinating Inorganic Compounds by Direct Fluorination AFF2, CYP4F2, AFF1 ESR1 1446/4885TRIM24 3607/4885TRIM33 2928/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.