Acetic Acid

Acetic Acid

SCHEMBL2590428

C=C(C)C(=O)OCCO.CC(=O)O

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

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 17)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.55
TSHR P16473 4/20 0.53
TDP1 Q9NUW8 2/20 0.44
POLB P06746 1/20 0.44
APEX1 P27695 1/20 0.44
HTT P42858 1/20 0.44
ALDH1A1 P00352 2/20 0.42
ACHE P22303 1/20 0.34
CA1 P00915 3/20 0.33
CA2 P00918 3/20 0.33
FFAR3 O14843 1/20 0.32
LCK P06239 1/20 0.32
FYN P06241 1/20 0.32
TGFBR1 P36897 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31

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
SCHEMBL14886 0.95
SCHEMBL29229747 0.95 THRB (0.59) THRBTSHRTDP1POLBAPEX1
SCHEMBL6864388 0.95 THRB (0.59) THRBTSHRTDP1POLBAPEX1
Benzene SCHEMBL28116485 0.93 THRB (0.53) THRBTSHRTDP1POLBAPEX1
Methacrylic Acid SCHEMBL467445 0.93 THRB (0.53) THRBTSHRTDP1POLBAPEX1
Methacrylic Acid SCHEMBL9453862 0.93 THRB (0.53) THRBTSHRTDP1POLBAPEX1
Ethylene SCHEMBL1248384 0.93 THRB (0.57) THRBTSHRTDP1POLBAPEX1
Ethylene SCHEMBL10530398 0.93 THRB (0.57) THRBTSHRTDP1POLBAPEX1
Ethylene SCHEMBL629900 0.93 THRB (0.57) THRBTSHRTDP1POLBAPEX1
SCHEMBL20701421 0.93 THRB (0.57) THRBTSHRTDP1POLBAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9717672-B2 Compositions and methods for UV-curable cosmetic nail coatings CREATIVE NAIL DESIGN, INC. (US) 2017-08-01 US claimed
US-20160038400-A1 COMPOSITIONS AND METHODS FOR UV-CURABLE COSMETIC NAIL COATINGS MUFG BANK LTD. AS AGENT 2016-02-11 US claimed
US-8901199-B2 Compositions and methods for UV-curable cosmetic nail coatings CREATIVE NAIL DESIGN, INC. (US) 2014-12-02 US claimed
EP-2683350-A1 COMPOSITIONS AND METHODS FOR UV-CURABLE COSMETIC NAIL COATINGS Creative Nail Design, Inc. (US) 2014-01-15 EP claimed
WO-2012121704-A1 COMPOSITIONS AND METHODS FOR UV-CURABLE COSMETIC NAIL COATINGS CREATIVE NAIL DESIGN, INC. (US) 2012-09-13 WO claimed
US-20110274633-A1 COMPOSITIONS AND METHODS FOR UV-CURABLE COSMETIC NAIL COATINGS COLOMER USA (US) 2011-11-10 US claimed
US-4192685-A POLY(METH)ACRYLATE COMPOUND, UNSATURATED AMIDE, UNSATURATED ESTER AS CROSSLINKERS TEIJIN LIMITED (JP) 1980-03-11 US claimed
US-10603264-B2 Silsesquioxanes and use in nail coatings thereof REVLON CONSUMER PRODUCTS CORPORATION (US) 2020-03-31 US disclosed
US-20190192411-A1 SILSESQUIOXANES AND USE IN NAIL COATINGS THEREOF MUFG BANK LTD. AS AGENT 2019-06-27 US disclosed
US-9717672-B2 Compositions and methods for UV-curable cosmetic nail coatings CREATIVE NAIL DESIGN, INC. (US) 2017-08-01 US disclosed
US-9713585-B2 Nail coatings having enhanced adhesion CREATIVE NAIL DESIGN, INC. (US) 2017-07-25 US disclosed
US-20170056313-A1 NAIL COATINGS HAVING ENHANCED ADHESION CREATIVE NAIL DESIGN, INC. (US) 2017-03-02 US disclosed
US-20160067164-A1 NAIL COATINGS HAVING ENHANCED ADHESION MUFG BANK LTD. AS AGENT 2016-03-10 US disclosed
US-20150044150-A1 COMPOSITIONS AND METHODS FOR UV-CURABLE COSMETIC NAIL COATINGS CREATIVE NAIL DESIGN, INC. 2015-02-12 US disclosed
US-8901199-B2 Compositions and methods for UV-curable cosmetic nail coatings CREATIVE NAIL DESIGN, INC. (US) 2014-12-02 US disclosed
WO-2014176275-A1 NAIL COATINGS HAVING ENHANCED ADHESION CREATIVE NAIL DESIGN, INC. (US) 2014-10-30 WO disclosed
EP-2683350-A1 COMPOSITIONS AND METHODS FOR UV-CURABLE COSMETIC NAIL COATINGS Creative Nail Design, Inc. (US) 2014-01-15 EP disclosed
CN-103501755-A Compositions and methods for UV-curable cosmetic nail coatings CREATIVE NAIL DESIGN INC 2014-01-08 CN disclosed
WO-2012121704-A1 COMPOSITIONS AND METHODS FOR UV-CURABLE COSMETIC NAIL COATINGS CREATIVE NAIL DESIGN, INC. (US) 2012-09-13 WO disclosed
US-20110274633-A1 COMPOSITIONS AND METHODS FOR UV-CURABLE COSMETIC NAIL COATINGS COLOMER USA (US) 2011-11-10 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 (4 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-20190192411-A1 SILSESQUIOXANES AND USE IN NAIL COATINGS THEREOF POLR1C, BMI1, DPM1 THRB 2646/4885TSHR 2403/4885TDP1 2622/4885
US-10603264-B2 Silsesquioxanes and use in nail coatings thereof POLR1C, BMI1, DPM1 THRB 2646/4885TSHR 2403/4885TDP1 2622/4885
US-20160067164-A1 NAIL COATINGS HAVING ENHANCED ADHESION PIK3C3, POLR1C, NACA THRB 2911/4885TSHR 3794/4885TDP1 2169/4885
US-20170056313-A1 NAIL COATINGS HAVING ENHANCED ADHESION POLR1C, PIK3C3, NACA THRB 3401/4885TSHR 4023/4885TDP1 1959/4885

“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.