Acetone

Acetone

SCHEMBL6926852

CC(C)=O.[Na+].[OH-]

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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

⚠ 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
Acetone SCHEMBL27673638 0.94
Acetone SCHEMBL1616144 0.88
Acetone SCHEMBL28196733 0.88
Acetone SCHEMBL7365015 0.88
Acetone SCHEMBL28965254 0.88
Acetone SCHEMBL28247094 0.88
Acetone SCHEMBL3134673 0.88
Acetone SCHEMBL528137 0.87 LMNA (1.00)
Acetone SCHEMBL662 0.87
Acetone SCHEMBL5665105 0.87 LMNA (1.00)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115918649-A Preparation method and application of auxiliary agent for propanil suspending agent 南京太化化工有限公司 2023-04-07 CN claimed
CN-107584622-B Recombined bamboo with mildew-proof function and preparation method thereof 广东省林业科学研究院 2021-05-14 CN claimed
CN-107584611-B Recombined wood with mildew-proof function and preparation method thereof 广东省林业科学研究院 2021-04-30 CN claimed
CN-107584602-B Outdoor bamboo product long-acting mildew preventive and preparation method thereof 广东省林业科学研究院 2021-03-26 CN claimed
CN-108690328-A A kind of photosensitive resin and preparation method thereof for 3D printing 上海云铸三维科技有限公司 2018-10-23 CN claimed
CN-107584611-A A kind of Scrimber with antimildew function and preparation method thereof 广东省林业科学研究院 2018-01-16 CN claimed
CN-107584622-A A kind of Recombined bamboo with antimildew function and preparation method thereof 广东省林业科学研究院 2018-01-16 CN claimed
CN-107584602-A A kind of outdoor bamboo wood product long-acting mould-proof agent and preparation method thereof 广东省林业科学研究院 2018-01-16 CN claimed
CN-104004002-B A kind of method directly being prepared 6-amino-penicillanic acid by penicillin fermentation liquid 河北天俱时生物科技有限公司 2016-09-14 CN claimed
CN-104666304-A Compound drug composition prepared from losartan potassium and hydrochlorothiazide crystal compound ZHANG MIN 2015-06-03 CN claimed
CN-104644643-A Valsartan pharmaceutical composition of compound hydrochlorothiazide crystal compound ZHANG MIN 2015-05-27 CN claimed
CN-104644642-A Pharmaceutical composition of composite irbesartan hydrochlorothiazide and preparation method thereof ZHANG MIN 2015-05-27 CN claimed
US-4277248-A FORMATION OF SCHIFF BASE WITH P-DIMETHYLAMINOCINNAMALDEHYDE HOFFMANN-LA ROCHE INC. (US) 1981-07-07 US claimed
CN-117940133-A Therapeutic agents for degradation of mutant BRAF C4医药公司 2024-04-26 CN disclosed
CN-115746152-B Thallium ion adsorbent and preparation method thereof 宁波大学 2024-02-06 CN disclosed
CN-113769727-B High-stability solid base catalyst and preparation method thereof 中海油天津化工研究设计院有限公司 2023-12-08 CN disclosed
CN-1342170-A Method for cross-linking hyaluronic acid to polymers VITROLEF BRITISH CO LTD (GB) 2002-03-27 CN disclosed
US-20010056211-A1 Guaiacoxypropanolamines with alpha/beta adrenergic blocking activity NATIONAL SCIENCE COUNCIL (TW) 2001-12-27 US disclosed
WO-2001046214-A2 COMPOUND COMPRISING A NUCLEIC ACID MOIETY AND AN ORGANO-SILANE MOIETY VBC-GENOMICS BIOSCIENCE RESEARCH GMBH (AT) 2001-06-28 WO disclosed
EP-1110967-A1 Compound comprising a biomolecule moiety and an organo-silane moiety LION Bioscience AG (DE) 2001-06-27 EP disclosed