Acetic Acid

Acetic Acid

SCHEMBL4980947

CC(=O)O.CCC(Cl)(Cl)Cl

nearest known ligand 0.47

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 19)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 3/20 0.47
LCK P06239 1/20 0.47
FYN P06241 1/20 0.47
ALDH1A1 P00352 5/20 0.39
TSHR P16473 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
TP53 P04637 1/20 0.39
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
MEN1 O00255 2/20 0.32
CYP1A2 P05177 2/20 0.32
KMT2A Q03164 2/20 0.32
THRB P10828 1/20 0.32
LMNA P02545 3/20 0.32
SLC15A2 Q16348 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CA4 P22748 1/20 0.32

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 SCHEMBL10775461 0.91 FFAR3 (0.39) FFAR3LCKFYNALDH1A1TSHR
Cyclohexane SCHEMBL28420503 0.91 FFAR3 (0.40) FFAR3LCKFYNALDH1A1TSHR
Acetic Acid SCHEMBL31254063 0.84 FFAR3 (0.44) FFAR3LCKFYNALDH1A1TSHR
Methacrylic Acid SCHEMBL28927409 0.83 TDP1 (0.35) FFAR3LCKFYNALDH1A1TSHR
Acetic Acid SCHEMBL10866598 0.80 FFAR3 (0.47) FFAR3LCKFYNALDH1A1TSHR
Trichlorethanol SCHEMBL2141590 0.80 FFAR3 (0.47) FFAR3LCKFYNALDH1A1TSHR
Acetic Acid SCHEMBL10593009 0.79 FFAR3 (0.39) FFAR3LCKFYNALDH1A1TSHR
Carbon Tetrachloride SCHEMBL3963583 0.78
SCHEMBL22731 0.78
Trichlorethanol SCHEMBL8976783 0.78 FFAR3 (0.44) FFAR3LCKFYNALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022071226-A1 RESIN COMPOSITION, CURED PRODUCT, LAMINATE, CURED PRODUCT PRODUCTION METHOD, AND SEMICONDUCTOR DEVICE 富士フイルム株式会社 2022-04-07 WO disclosed
CN-108218949-B Preparation method of 3, 29-dibenzoyl trichosanthes kirilowii kernel triol reference substance 上海诗丹德标准技术服务有限公司 2020-12-18 CN disclosed
US-7348433-B2 Quinolinones as prostaglandin receptor ligands MERCK FROSST CANADA & CO. (CA) 2008-03-25 US disclosed
EP-1458718-B1 QUINOLINONES AS PROSTAGLANDIN RECEPTOR LIGANDS MERCK FROSST CANADA LTD (CA) 2006-10-25 EP disclosed
US-20050222194-A1 Quinolinones as prostaglandin receptor ligands MERCK FROSST CANADA LTD. (CA) 2005-10-06 US disclosed
EP-1458718-A1 QUINOLINONES AS PROSTAGLANDIN RECEPTOR LIGANDS Merck Frosst Canada & Co. (CA) 2004-09-22 EP disclosed
WO-2003051878-A1 QUINOLINONES AS PROSTAGLANDIN RECEPTOR LIGANDS MERCK FROSST CANADA & CO. (CA) 2003-06-26 WO disclosed
US-5591862-A ANTILIPEMICS, TREATING DIABETES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-01-07 US disclosed
EP-0451538-B1 Use of pyridoindole derivatives in the treatment of ischemic disorders FUJISAWA PHARMACEUTICAL CO (JP) 1996-05-22 EP disclosed
EP-0361317-B1 Pyridoindole derivatives and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO (JP) 1995-04-05 EP disclosed
US-5290785-A Therapeutic agent for ischemic diseases FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-03-01 US disclosed
US-5173493-A For treatment or prevention of nausea or vomiting FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1992-12-22 US disclosed
US-5141945-A 5-Hydroxytryptamine antagonists, treatment or prevention of nausea and vomiting FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1992-08-25 US disclosed
EP-0451538-A2 Use of pyridoindole derivatives in the treatment of ischemic disorders FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-10-16 EP disclosed
EP-0361317-A2 Pyridoindole derivatives and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-04-04 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-20050222194-A1 Quinolinones as prostaglandin receptor ligands PTGFR, PTGER1, PTGER2 FFAR3 162/4885LCK 1682/4885FYN 2329/4885

“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.