Ethyl Acetate

Ethyl Acetate

SCHEMBL516058

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nearest known ligand 0.93

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM5 known ✓ P08912 2/20 0.42
CHRM1 known ✓ P11229 2/20 0.42
CHRM3 known ✓ P20309 2/20 0.42
CHRM2 known ✓ P08172 1/20 0.42
CHRM4 known ✓ P08173 1/20 0.42
HTR1A known ✓ P08908 1/20 0.42
ALDH1A1 P00352 6/20 0.93
LMNA P02545 1/20 0.93
HSD17B10 Q99714 1/20 0.93
TSHR P16473 2/20 0.55
GAA P10253 2/20 0.50
ALOX15 P16050 1/20 0.50
MGAM O43451 1/20 0.50
SI P14410 1/20 0.50
MGAM2 Q2M2H8 1/20 0.50
SOAT1 P35610 1/20 0.50
TRPA1 O75762 1/20 0.46
GLO1 Q04760 1/20 0.44
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43

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
Ethyl Acetate SCHEMBL18498857 1.00 ALDH1A1 (0.93) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL16267234 1.00 ALDH1A1 (0.93) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL192603 1.00 ALDH1A1 (0.93) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL508898 1.00 ALDH1A1 (0.93) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL525361 1.00 ALDH1A1 (0.93) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL5036694 1.00 ALDH1A1 (0.93) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL9731700 1.00 ALDH1A1 (0.93) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL18237169 1.00 ALDH1A1 (0.93) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL1163855 1.00 ALDH1A1 (0.93) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL1150646 1.00 ALDH1A1 (0.93) ALDH1A1LMNAHSD17B10TSHRGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024149261-A1 INHIBITOR OF COMPLEMENT FACTOR B 南京正大天晴制药有限公司 2024-07-18 WO disclosed
CN-118307564-A Nitrogen-containing heterocyclic compound, and preparation method and application thereof 深圳信立泰药业股份有限公司 2024-07-09 CN disclosed
CN-118159541-A Gonadotropin releasing hormone antagonist and preparation method and application thereof 山东绿叶制药有限公司 2024-06-07 CN disclosed
US-20240182465-A1 FUSED RING SUBSTITUTED SIX-MEMBERED HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) 2024-06-06 US disclosed
EP-3778573-B1 COMPOUND WITH ANTICANCER ACTIVITY KYOWA KIRIN CO LTD (JP) 2024-04-24 EP disclosed
US-20240116989-A1 PROCESS FOR THE PREPARATION OF CYCLIC DEPSIPEPTIDES ONKURE, INC. (US) 2024-04-11 US disclosed
CN-115232144-B Nitrogen-containing condensed ring derivative, pharmaceutical composition, and preparation method and application thereof 长春金赛药业有限责任公司 2024-04-02 CN disclosed
US-20240083853-A1 HSD17B13 INHIBITORS AND USES THEREOF FL2022-001, INC. 2024-03-14 US disclosed
CN-111936468-B Compounds with anticancer activity 协和麒麟株式会社 2024-03-08 CN disclosed
CN-117486876-A Compounds as inhibitors of Akt kinase 正大天晴药业集团股份有限公司 2024-02-02 CN disclosed
US-20040106595-A1 2H-1-benzopyran derivatives processes for their preparation and pharmaceutical compositions thereof CHIESI FARMACEUTICI S.P.A. (IT) 2004-06-03 US disclosed
CN-1487934-A 2H-1-benzopyran derivatives, process for their preparation and pharmaceutical compositions containing them ������˹ҩƷ��˾ 2004-04-07 CN disclosed
US-20040029819-A1 Process for the synthesis of optically active anthracyclines MENARINI RICERCHE S.P.A. (IT) 2004-02-12 US disclosed
CN-1474827-A Process for synthesis of optically active anthracyclines ÷�������о����ɷݹ�˾ 2004-02-11 CN disclosed
EP-1355906-A1 2H-1-BENZOPYRAN DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS THEREOF CHIESI FARMACEUTICI S.p.A. (IT) 2003-10-29 EP disclosed
EP-1335927-A1 PROCESS FOR THE SYNTHESIS OF OPTICALLY ACTIVE ANTHRACYCLINES Menarini Ricerche S.p.A. (IT) 2003-08-20 EP disclosed
CN-1411444-A Vitronectin receptor antagonist bicyclic compounds, preparation method and compositions containing same SEUWIEL LAB (FR) 2003-04-16 CN disclosed
WO-2002059113-A1 2H-1-BENZOPYRAN DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS THEREOF CHIESI FARMACEUTICI S.P.A. (IT) 2002-08-01 WO disclosed
WO-2002040496-A1 PROCESS FOR THE SYNTHESIS OF OPTICALLY ACTIVE ANTHRACYCLINES MENARINI RICERCHE S.P.A. (IT) 2002-05-23 WO disclosed
US-5043152-A Radiography GUERBET S.A. (FR) 1991-08-27 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 (5 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-20240116989-A1 PROCESS FOR THE PREPARATION OF CYCLIC DEPSIPEPTIDES VIP, LPXN, NGLY1 CHRM5 2386/4885CHRM1 1472/4885CHRM3 2988/4885
US-20040106595-A1 2H-1-benzopyran derivatives processes for their preparation and pharmaceutical compositions thereof CYP19A1, BRCA1, HPD CHRM5 2447/4885CHRM1 1663/4885CHRM3 2062/4885
US-20240083853-A1 HSD17B13 INHIBITORS AND USES THEREOF HSD17B3, HSD17B11, HSD17B1 CHRM5 4868/4885CHRM1 4876/4885CHRM3 4474/4885
US-20240182465-A1 FUSED RING SUBSTITUTED SIX-MEMBERED HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF WEE1, WEE2, HASPIN CHRM5 4855/4885CHRM1 4669/4885CHRM3 4663/4885
US-20040029819-A1 Process for the synthesis of optically active anthracyclines DHPS, GNPAT, CYP8B1 CHRM5 3971/4885CHRM1 3900/4885CHRM3 4231/4885

“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.