Acetic Acid

Acetic Acid

SCHEMBL6397604

CC(=O)O.CCCCCCCCCCNCCCCCCCCCC

nearest known ligand 0.65

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Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Acetic Acid. 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
ALDH1A1 P00352 2/20 0.65
TSHR P16473 2/20 0.65
S1PR2 O95136 5/20 0.57
S1PR4 O95977 5/20 0.57
S1PR1 P21453 5/20 0.57
S1PR3 Q99500 5/20 0.57
S1PR5 Q9H228 1/20 0.57
EPHX1 P07099 7/20 0.56
PAOX Q6QHF9 1/20 0.56
ADH1B P00325 1/20 0.52
ADH1C P00326 1/20 0.52
ADH1A P07327 1/20 0.52
ADH4 P08319 1/20 0.52
ADH7 P40394 1/20 0.52
CASP2 P42575 1/20 0.50
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
SLC22A6 Q4U2R8 1/20 0.48
SLC22A8 Q8TCC7 1/20 0.48
GPR84 Q9NQS5 1/20 0.48

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
Acetic Acid SCHEMBL6396718 1.00 ALDH1A1 (0.65) ALDH1A1TSHRS1PR2S1PR4S1PR1
Acetic Acid SCHEMBL28211743 1.00 ALDH1A1 (0.65) ALDH1A1TSHRS1PR2S1PR4S1PR1
Acetic Acid SCHEMBL6391178 1.00 ALDH1A1 (0.65) ALDH1A1TSHRS1PR2S1PR4S1PR1
Acetic Acid SCHEMBL28761306 1.00 ALDH1A1 (0.65) ALDH1A1TSHRS1PR2S1PR4S1PR1
Acetic Acid SCHEMBL28014546 1.00 ALDH1A1 (0.65) ALDH1A1TSHRS1PR2S1PR4S1PR1
Acetic Acid SCHEMBL2513857 1.00 ALDH1A1 (0.65) ALDH1A1TSHRS1PR2S1PR4S1PR1
Acetic Acid SCHEMBL28423657 1.00 ALDH1A1 (0.65) ALDH1A1TSHRS1PR2S1PR4S1PR1
Acetic Acid SCHEMBL8088016 0.98 ALDH1A1 (0.62) ALDH1A1TSHRS1PR2S1PR4S1PR1
Acetic Acid SCHEMBL8087701 0.98 ALDH1A1 (0.62) ALDH1A1TSHRS1PR2S1PR4S1PR1
Acetic Acid SCHEMBL7569435 0.98 ALDH1A1 (0.62) ALDH1A1TSHRS1PR2S1PR4S1PR1

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114507303-A External electron donor for olefin polymerization, catalyst system and olefin polymerization method 中国石油化工股份有限公司 2022-05-17 CN claimed
CN-114478870-A Catalyst system for olefin polymerization and olefin polymerization method 中国石油化工股份有限公司 2022-05-13 CN claimed
US-20020016505-A1 Heat storage material having solid/solid phase transition remains solid through application; heat resistance; materials handling MERCK PATENT GMBH (DE) 2002-02-07 US claimed
EP-1148108-A1 Storage media for latent heat storage units MERCK PATENT GmbH (DE) 2001-10-24 EP claimed
CN-114507303-A External electron donor for olefin polymerization, catalyst system and olefin polymerization method 中国石油化工股份有限公司 2022-05-17 CN disclosed
CN-114478870-A Catalyst system for olefin polymerization and olefin polymerization method 中国石油化工股份有限公司 2022-05-13 CN disclosed
US-9054067-B2 Semiconductor package with thermal dissipating member and method of manufacturing the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-06-09 US disclosed
US-20140217576-A1 SEMICONDUCTOR PACKAGE SAMSUNG ELECTRONICS CO., LTD. (KR) 2014-08-07 US disclosed
CN-1589496-A Optimal Application of Phase Change Materials in Cooling Devices MERCK PATENT GMBH (DE) 2005-03-02 CN disclosed
US-20050007740-A1 Optimised application of pcms in chillers MERCK PATENT GMBH (DE) 2005-01-13 US disclosed
WO-2003093391-A1 SURFACE MODIFICATION OF PHASE CHANGE MATERIALS MERCK PATENT GMBH (DE) 2003-11-13 WO disclosed
EP-0835924-B1 Use of an additive for dispersing calcium sulfate in a lubricating oil for diesel engines KAO CORP (JP) 2002-09-11 EP disclosed
US-20020033247-A1 Use of PCMs in heat sinks for electronic components MERCK PATENT GMBH (DE) 2002-03-21 US disclosed
US-20020016505-A1 Heat storage material having solid/solid phase transition remains solid through application; heat resistance; materials handling MERCK PATENT GMBH (DE) 2002-02-07 US disclosed
CN-1329361-A Application of phase transformation material in radiator for electronic element and device MERCK PATENT GMBH (DE) 2002-01-02 CN disclosed
EP-1162659-A2 Use of PCM in heat sinks for electronic devices MERCK PATENT GmbH (DE) 2001-12-12 EP disclosed
EP-1148108-A1 Storage media for latent heat storage units MERCK PATENT GmbH (DE) 2001-10-24 EP disclosed
EP-0835924-A1 LUBRICATING OIL ADDITIVE AND LUBRICATING OIL COMPOSITION FOR DIESEL ENGINES Kao Corporation (JP) 1998-04-15 EP 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-20020016505-A1 Heat storage material having solid/solid phase transition remains solid through application; heat resistance; materials handling HSPH1, HSP90AA1, HSPA1A ALDH1A1 1431/4885TSHR 4373/4885S1PR2 4334/4885

“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.