Acrylic Acid Ethyl Ester

Acrylic Acid Ethyl Ester

SCHEMBL259837

C=C(C)C(=O)OC.C=C(C)C(=O)OC.C=C(CCC)C(=O)O.C=CC(=O)OCC.C=CC(=O)OCC.CN(C)C.CN(C)C.Cl

nearest known ligand 0.38

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 Acrylic Acid Ethyl Ester. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
TSHR P16473 5/20 0.35
HPGD P15428 1/20 0.35
THRB P10828 1/20 0.31
ALOX15 P16050 1/20 0.30
HSD17B10 Q99714 1/20 0.30
HCAR2 Q8TDS4 1/20 0.30

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
Acrylic Acid Ethyl Ester SCHEMBL147655 1.00 ALDH1A1 (0.38) ALDH1A1TSHRHPGDTHRBALOX15
Acrylic Acid Ethyl Ester SCHEMBL146753 1.00 ALDH1A1 (0.38) ALDH1A1TSHRHPGDTHRBALOX15
Acrylic Acid Ethyl Ester SCHEMBL443509 0.99 ALDH1A1 (0.39) ALDH1A1TSHRHPGDTHRBALOX15
Acrylic Acid Ethyl Ester SCHEMBL259713 0.90 ALDH1A1 (0.40) ALDH1A1TSHRHPGDTHRBALOX15
Acrylic Acid Ethyl Ester SCHEMBL5827836 0.90 ALDH1A1 (0.44) ALDH1A1TSHRHPGDTHRBHSD17B10
Acrylic Acid Ethyl Ester SCHEMBL28021684 0.90 ALDH1A1 (0.44) ALDH1A1TSHRHPGDTHRBHSD17B10
Acrylic Acid Ethyl Ester SCHEMBL12100195 0.88 ALDH1A1 (0.41) ALDH1A1TSHRHPGDTHRBALOX15
Trimethylammonium SCHEMBL6326203 0.88 ALDH1A1 (0.43) ALDH1A1TSHRTHRB
Trimethylammonium SCHEMBL7355812 0.88 ALDH1A1 (0.43) ALDH1A1TSHRTHRB
Trimethylammonium SCHEMBL7354581 0.88 ALDH1A1 (0.43) ALDH1A1TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120294938-A1 PHARMACEUTICAL PREPARATION FOR ORAL ADMINISTRATION WITH CONTROLLED ACTIVE INGREDIENT RELEASE IN THE SMALL INTESTINE AND METHOD FOR ITS PRODUCTION Dr. R. Pflefger Chemische Fabrik GmbH (DE) 2012-11-22 US claimed
EP-1880718-B1 Pharmaceutical preparation for oral administration with controlled drug release in the small intestine colon and process of prepartion thereof PFLEGER R CHEM FAB (DE) 2011-09-21 EP claimed
US-20090285891-A1 Pharmaceutical preparation for oral administration with controlled active ingredient release in the small intestine and method for its production DR. R. PFLEGER CHEMISCHE FABRIK GMBH (DE) 2009-11-19 US claimed
US-7611730-B2 Tramadol-based medicament GRUNENTHAL GMBH (DE) 2009-11-03 US claimed
EP-1372624-B1 TRAMADOL-BASED MEDICAMENT GRUENENTHAL GMBH (DE) 2005-08-24 EP claimed
US-20040076669-A1 Tramadol-based medicament GRUNENTHAL GMBH (DE) 2004-04-22 US claimed
US-4876092-A SUSTAINED RELEASE; ACRYLIC POLYMERS, POLYOLS, DRUGS AND PLASTICIZER TEIKOKU SEIYAKU KABUSHIKI KAISHA (JP) 1989-10-24 US claimed
CN-117425471-A Prolonged release compositions comprising tomoxetine 图莱克斯制药公司 2024-01-19 CN disclosed
CN-105813643-A Methods of treating non-small cell lung cancer using pharmaceutical formulations containing thienotriazolodiazepine compounds 翁科埃斯克斯有限公司 2016-07-27 CN disclosed
US-9132101-B2 Administration form based on cross-linked hydrophilic polymers LTS LOHMANN THERAPIE-SYSTEME AG (DE) 2015-09-15 US disclosed
EP-2832730-A1 MIRABEGRON-CONTAINING PHARMACEUTICAL COMPOSITION Astellas Pharma Inc. (JP) 2015-02-04 EP disclosed
US-20150031734-A1 PHARMACEUTICAL COMPOSITION CONTAINING MIRABEGRON ASTELLAS PHARMA INC. (JP) 2015-01-29 US disclosed
US-20120294938-A1 PHARMACEUTICAL PREPARATION FOR ORAL ADMINISTRATION WITH CONTROLLED ACTIVE INGREDIENT RELEASE IN THE SMALL INTESTINE AND METHOD FOR ITS PRODUCTION Dr. R. Pflefger Chemische Fabrik GmbH (DE) 2012-11-22 US disclosed
US-7510729-B2 Time-release agents; mechanical/storage stability; tablets BASF AKTIENGESELLSCHAFT (DE) 2009-03-31 US disclosed
US-20080286342-A1 Form of Administration Based on Crosslinked Hydrophilic Polymers LTS LOHMANN THERAPIE-SYSTEME AG (DE) 2008-11-20 US disclosed
US-20070086955-A1 Form of administration for controlling primary headaches LTS LOHMANN THERAPIE-SYSTEME AG (DE) 2007-04-19 US disclosed
US-20070071796-A1 Administration form based on cross-linked hydrophilic polymers LTS LOHMANN THERAPIE-SYSTEME AG (DE) 2007-03-29 US disclosed
EP-1661898-A1 BICYCLIC PIPERAZINE COMPOUND AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2006-05-31 EP disclosed
US-20050106252-A1 Combination of polyvinyl acetate with water-insoluble, acid-insoluble, or alkali-insoluble polymers used for the production of film coatings with highly controlled release and high stability BASF AKTIENGESELLSCHAFT (DE) 2005-05-19 US disclosed
US-20040076669-A1 Tramadol-based medicament GRUNENTHAL GMBH (DE) 2004-04-22 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 (1 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-20150031734-A1 PHARMACEUTICAL COMPOSITION CONTAINING MIRABEGRON GCGR, GPR119, GLP1R ALDH1A1 1800/4885TSHR 499/4885HPGD 1633/4885

“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.