Acetic Acid

Acetic Acid

SCHEMBL30876192

CC(=O)O.N=C(Nc1ccccc1)Nc1ccccc1

nearest known ligand 0.64

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
NAPRT Q6XQN6 1/20 0.64
HSD17B10 Q99714 1/20 0.64
EPHX1 P07099 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
TSHR P16473 2/20 0.56
TP53 P04637 1/20 0.56
EPHX2 P34913 1/20 0.56
CDK9 P50750 1/20 0.56
CLK4 Q9HAZ1 1/20 0.56
MAPT P10636 5/20 0.55
KMT2A Q03164 3/20 0.55
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
TAAR1 Q96RJ0 2/20 0.55
POLB P06746 2/20 0.55
GAA P10253 2/20 0.55
ALDH1A1 P00352 2/20 0.55
LMNA P02545 1/20 0.55
ATM Q13315 1/20 0.55
CYP1A2 P05177 1/20 0.53

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 SCHEMBL27669514 0.90 NAPRT (0.57) NAPRTHSD17B10EPHX1SMN1; SMN2TSHR
Oxalic Acid SCHEMBL30876191 0.88 SMN1; SMN2 (0.58) NAPRTHSD17B10EPHX1SMN1; SMN2TSHR
SCHEMBL20163213 0.88 HSD17B10 (0.55) NAPRTHSD17B10EPHX1SMN1; SMN2TSHR
Benzene SCHEMBL27899223 0.88 HSD17B10 (0.55) NAPRTHSD17B10EPHX1SMN1; SMN2TSHR
SCHEMBL35172 0.88 HSD17B10 (0.55) NAPRTHSD17B10EPHX1SMN1; SMN2TSHR
Hydrogen Sulfide SCHEMBL28324183 0.85 TAS2R38 (0.52) NAPRTHSD17B10EPHX1SMN1; SMN2TSHR
Bromide SCHEMBL473887 0.85 TAS2R38 (0.52) NAPRTHSD17B10EPHX1SMN1; SMN2TSHR
Fluoride SCHEMBL20815438 0.85 TAS2R38 (0.52) NAPRTHSD17B10EPHX1SMN1; SMN2TSHR
SCHEMBL31160596 0.85 TAS2R38 (0.52) NAPRTHSD17B10EPHX1SMN1; SMN2TSHR
Hydrochloric Acid SCHEMBL5608654 0.85 TAS2R38 (0.52) NAPRTHSD17B10EPHX1SMN1; SMN2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260101901-A1 DELAYING BLOOM IN HORTICULTURAL CROPS USING JASMONIC ACID BIOSYNTHESIS INHIBITORS VIRGINIA TECH INTELLECTUAL PROPERTIES INC (US) 2026-04-16 US disclosed
WO-2024073357-A1 DELAYING BLOOM IN HORTICULTURAL CROPS USING JASMONIC ACID BIOSYNTHESIS INHIBITORS VIRGINIA TECH INTELLECTUAL PROPERTIES INC. (US) 2024-04-04 WO 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-20260101901-A1 DELAYING BLOOM IN HORTICULTURAL CROPS USING JASMONIC ACID BIOSYNTHESIS INHIBITORS FADS2, DDT, MYB NAPRT 2363/4885HSD17B10 468/4885EPHX1 843/4885

“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.