Acetic Acid

Acetic Acid

SCHEMBL6251436

CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.NCCN.NCCN.NCCN.NCCN

nearest known ligand 0.58

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 20)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 2/20 0.58
LCK P06239 1/20 0.58
FYN P06241 1/20 0.58
GLRA1 P23415 1/20 0.47
SLC6A9 P48067 1/20 0.47
OR51E2 Q9H255 1/20 0.47
LMNA P02545 5/20 0.43
GABRR1 P24046 3/20 0.43
BLM P54132 3/20 0.43
PAOX Q6QHF9 3/20 0.43
ALOX15 P16050 2/20 0.43
PMP22 Q01453 1/20 0.43
THRB P10828 2/20 0.42
KMT2A Q03164 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
GABRR3 A8MPY1 1/20 0.42
GABRP O00591 1/20 0.42
GABRD O14764 1/20 0.42
HDAC3 O15379 1/20 0.42
GABBR2 O75899 1/20 0.42

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 SCHEMBL1665368 1.00 FFAR3 (0.58) FFAR3LCKFYNGLRA1SLC6A9
Acetic Acid SCHEMBL20617 1.00 FFAR3 (0.58) FFAR3LCKFYNGLRA1SLC6A9
Acetic Acid SCHEMBL11012463 1.00 FFAR3 (0.58) FFAR3LCKFYNGLRA1SLC6A9
Acetic Acid SCHEMBL344632 1.00
Acetic Acid SCHEMBL9098767 1.00 FFAR3 (0.58) FFAR3LCKFYNGLRA1SLC6A9
Acetic Acid SCHEMBL3634629 1.00 FFAR3 (0.58) FFAR3LCKFYNGLRA1SLC6A9
Acetic Acid SCHEMBL8527135 1.00 FFAR3 (0.58) FFAR3LCKFYNGLRA1SLC6A9
Acetic Acid SCHEMBL1058300 1.00 FFAR3 (0.58) FFAR3LCKFYNGLRA1SLC6A9
Acetic Acid SCHEMBL3420431 1.00 FFAR3 (0.58) FFAR3LCKFYNGLRA1SLC6A9
Acetic Acid SCHEMBL220259 1.00 FFAR3 (0.58) FFAR3LCKFYNGLRA1SLC6A9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1227885-B1 PROCESS FOR THE PREPARATION OR REACTIVATION OF CARBON MONOXIDE HYDROGENATION CATALYSTS EXXONMOBIL RES & ENG CO (US) 2005-08-17 EP disclosed
US-20040105156-A1 Coated article KAYANOKI HISAYUKI (JP) 2004-06-03 US disclosed
US-6703131-B1 COATED PLASTIC LENS HAVING A TITANIUM OXIDE-CONTAINING RESIN COAT LAYER NIPPON ARC CO., LTD. (JP) 2004-03-09 US disclosed
US-6331574-B1 PRODUCING HYDROCARBONS USING CATALYST WITH INCREASED ACTIVITY FORMED BY REMOVING SOME OF METAL ATOMS WITH CHELATING COMPOUND CONTAINING NITROGEN OR OXYGEN AND HAVING DENTICITY OF AT LEAST TWO EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2001-12-18 US disclosed
EP-1162245-A1 COATED ARTICLE NIPPON ARC CO., LTD. (JP) 2001-12-12 EP disclosed
US-20010047041-A1 Process for the preparation of high activity carbon monoxide hydrogenation catalysts; the catalyst compositions, use of the catalysts for conducting such reactions, and the products of such reactions LAPIDUS ABERT L VOVOCH (RU) 2001-11-29 US disclosed
US-6221820-B1 Granular component containing alkylaminotriazole for use in machine dishwashing detergents HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-04-24 US disclosed
EP-0602125-A1 QUINAZOLINE DERIVATIVES AND THEIR PREPARATION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-06-22 EP disclosed
WO-1993005035-A1 QUINAZOLINE DERIVATIVES AND THEIR PREPARATION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-03-18 WO disclosed
US-5021381-A Syndiotactic 1,2-polybutadiene latex THE GOODYEAR TIRE & RUBBER COMPANY (US) 1991-06-04 US disclosed
EP-0357535-A1 Syndiotactic 1,2-polybutadiene latex THE GOODYEAR TIRE & RUBBER COMPANY (US) 1990-03-07 EP disclosed
US-4902741-A Syndiotactic 1,2-polybutadiene latex THE GOODYEAR TIRE & RUBBER COMPANY (US) 1990-02-20 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-20010047041-A1 Process for the preparation of high activity carbon monoxide hydrogenation catalysts; the catalyst compositions, use of the catalysts for conducting such reactions, and the products of such reactions KAT5, TAF5, C9 FFAR3 4795/4885LCK 833/4885FYN 405/4885

“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.