3,4,5-Trimethoxybenzoic Acid

3,4,5-Trimethoxybenzoic Acid

SCHEMBL11023599

COc1cc(C(=O)[O-])cc(OC)c1OC.[Na+]

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of 3,4,5-Trimethoxybenzoic 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
▸ TUBB4A known ✓ P04350 3/20 0.53
▸ TUBB known ✓ P07437 3/20 0.53
▸ TUBA3C known ✓ P0DPH7 3/20 0.53
▸ TUBA1B known ✓ P68363 3/20 0.53
▸ TUBA4A known ✓ P68366 3/20 0.53
▸ TUBB4B known ✓ P68371 3/20 0.53
▸ TUBB3 known ✓ Q13509 3/20 0.53
▸ TUBB2A known ✓ Q13885 3/20 0.53
▸ TUBB8 known ✓ Q3ZCM7 3/20 0.53
▸ TUBA3E known ✓ Q6PEY2 3/20 0.53
▸ TUBA1A known ✓ Q71U36 3/20 0.53
▸ TUBA1C known ✓ Q9BQE3 3/20 0.53
▸ TUBB6 known ✓ Q9BUF5 3/20 0.53
▸ TUBB2B known ✓ Q9BVA1 3/20 0.53
▸ TUBB1 known ✓ Q9H4B7 3/20 0.53
▸ CA1 known ✓ P00915 1/20 0.48
▸ CA2 known ✓ P00918 1/20 0.48
▸ TPMT P51580 1/20 0.52
▸ KMT2A Q03164 4/20 0.50
▸ MEN1 O00255 3/20 0.50

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
3,4,5-Trimethoxybenzoic Acid SCHEMBL10838605 0.96 TUBB4A (0.53) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
3,4,5-Trimethoxybenzoic Acid SCHEMBL9739811 0.96 TUBB4A (0.53) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
3,4,5-Trimethoxybenzoic Acid SCHEMBL10876051 0.86 ALDH1A1 (0.58) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
Syringic Acid SCHEMBL7700213 0.83 PKM (0.64) TPMTKMT2AMEN1MAPTCYP3A4
SCHEMBL28521735 0.82 CA1 (0.47) TPMTKMT2AMEN1CYP3A4ALDH1A1
SCHEMBL4819729 0.80 TUBB4A (0.75) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL4625442 0.80 TUBB1 (0.58) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
3,4,5-Trimethoxybenzoic Acid SCHEMBL6592 0.78 TPMT (0.78) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL4089388 0.78 TUBB4A (0.56) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
Hydrochloric Acid SCHEMBL27888195 0.78 TUBB4A (0.72) TUBB4ATUBBTUBA3CTUBA1BTUBA4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250129016-A1 PHOTOREDOX METHODS FOR RADIOCYANATION OF ARENES AND USE THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2025-04-24 — — US disclosed
EP-0160760-A1 Preparation of trimethoxybenzoate esters and trimethoxybenzoic acid Mallinckrodt, Inc. (a Delaware corporation) (US) 1985-11-13 — — EP disclosed
US-4471134-A Preparation of trimethoxybenzoate esters and trimethoxybenzoic acid MALLINCKRODT, INC. (US) 1984-09-11 — — US disclosed
US-4055653-A Sulfur containing trialkoxybenzoylamino carboxylic acids DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DT) 1977-10-25 — — US disclosed
US-4010193-A (ALKYLAMINO)ALKYL SUBSTITUTED BENZOATES, LOCAL ANESTHETIC, ANTIFIBRILLATORY, ANTIARRHYTHMIAL CHINOIN GYOGYSZER-ES VEGYESZETI TERMEKEK GYARA RT (HU) 1977-03-01 — — US disclosed
US-3981910-A Sulfur containing trialkoxybenzoylamino carboxylic acids DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DT) 1976-09-21 — — 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-20250129016-A1 PHOTOREDOX METHODS FOR RADIOCYANATION OF ARENES AND USE THEREOF RCC2, PPOX, FTO TUBB4A 3628/4885TUBB 4069/4885TUBA3C 3411/4885

“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.

Send feedback