Acetone

Acetone

SCHEMBL382840

CC(C)=O.Cl

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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 SCHEMBL27898995 1.00 LMNA (0.86)
Acetone SCHEMBL8130090 1.00
Acetone SCHEMBL2131124 1.00 LMNA (0.86)
Acetone SCHEMBL2131128 1.00
Acetone SCHEMBL28898273 1.00
Acetone SCHEMBL30428016 1.00
Acetone SCHEMBL15846712 0.94
Acetone SCHEMBL28965225 0.94
Acetone SCHEMBL5049779 0.94
Acetone SCHEMBL11612005 0.94 LMNA (0.75)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120058996-A Modified polystyrene resin and preparation method and application thereof 成都市润德药业有限公司 2025-05-30 CN claimed
CN-119661467-A Synthesis process of N- (4-phenylthiazole-2-yl) -3- (4-benzylpiperazine-1-yl) propionamide monohydrochloride 武汉亿诺药业有限公司 2025-03-21 CN claimed
CN-118667286-A Thermoplastic elastomer material and preparation method and application thereof 金发科技股份有限公司 2024-09-20 CN claimed
CN-114198052-B Method for improving cementing strength of two interfaces of marine natural gas hydrate stratum well cementation 中国石油大学(华东) 2024-05-28 CN claimed
CN-117756635-A Ester compound and preparation method and application thereof, and preparation method of (E, E, Z) -2,4, 6-methyltrienoic acid methyl ester 昆明博鸿科技有限公司 2024-03-26 CN claimed
CN-115501192-B Preparation method of propacetamol hydrochloride for injection 海南皇隆制药股份有限公司 2024-02-23 CN claimed
CN-115677655-B Synthesis method of epinastine intermediate 湖南省湘中制药有限公司 2023-12-08 CN claimed
US-11834425-B2 Full continuous-flow preparation method of vitamin B1 FUDAN UNIVERSITY (CN) 2023-12-05 US claimed
CN-114994160-B Analysis method for detecting formaldehyde-treated protein/polypeptide/amino acid food/product 天津医科大学 2023-09-15 CN claimed
CN-116675898-A Preparation method of cellulose-based composite aerogel with three-dimensional communicated hierarchical structure 贺州学院 2023-09-01 CN claimed
EP-1607387-A2 3,4,4-trisubstituted piperidine derivatives and their use as opioid antagonists ELI LILLY AND COMPANY (US) 2005-12-21 EP claimed
CN-1685835-A Microorganism plant growth regulating agent and its preparation method ANHUI UNIV OF AGRICULTURE (CN) 2005-10-26 CN claimed
CN-1566125-A Preparation method of scutellarin complex salt and preparation thereof BAI YONGCHENG (CN) 2005-01-19 CN claimed
CN-1450073-A Process for extracting and puritying haem WANG LIZHONG (CN) 2003-10-22 CN claimed
CN-1057294-C Preparation of 3,4, 4-trisubstituted piperidinyl-N-alkylcarboxylate compounds and intermediates LILLY CO ELI (US) 2000-10-11 CN claimed
EP-0984004-A2 Trisubstituted-piperidinyl-N-alkylcarboxylates as opioid antagonists ELI LILLY AND COMPANY (US) 2000-03-08 EP claimed
US-5959140-A LIQUID-PHASE OXIDATION OF AN ALKYL-GROUP-SUBSTITUTED AROMATIC COMPOUND IN ACETIC ACID WHICH COMPRISES DEHYDRATING WATER-CONTAINING ACETIC ACID BY AZEOTROPIC DISTILLATION IN AN AZEOTROPIC DISTILLATION DEHYDRATION TOWER TO RECYCLE THE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1999-09-28 US claimed
EP-0657428-A1 Preparation of 3,4,4-trisubstitutedpiperidinyl-n-alkylcarboxylates and intermediates, useful as opioid antagonists ELI LILLY AND COMPANY (US) 1995-06-14 EP claimed
CN-1096124-A A kind of initiative teaching appliance for chemistry WEI XUZHAN (CN) 1994-12-07 CN claimed
CN-1077197-A The extracting method of protoheme WANG LINFANG (CN) 1993-10-13 CN claimed