Thiamine Ion

Thiamine Ion

SCHEMBL10074

Cc1ncc(C[n+]2csc(CCO)c2C)c(N)n1.[Cl-]

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Thiamine Ion. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.98
TKT P29401 12/20 0.69
TDP1 Q9NUW8 1/20 0.68
KDM4E B2RXH2 1/20 0.67
LMNA P02545 1/20 0.63

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
Thiamine Ion SCHEMBL29572584 1.00 HSP90AA1 (0.98) HSP90AA1TKTTDP1KDM4ELMNA
Thiamine Ion SCHEMBL7090274 1.00 HSP90AA1 (0.98) HSP90AA1TKTTDP1KDM4ELMNA
Thiamine Ion SCHEMBL29445547 1.00 HSP90AA1 (0.98) HSP90AA1TKTTDP1KDM4ELMNA
Thiamine Ion SCHEMBL9618673 0.99 HSP90AA1 (0.95) HSP90AA1TKTTDP1KDM4ELMNA
Thiamine Ion SCHEMBL7110640 0.99 HSP90AA1 (0.95) HSP90AA1TKTTDP1KDM4ELMNA
Thiamine Ion SCHEMBL9391504 0.99 HSP90AA1 (0.95) HSP90AA1TKTTDP1KDM4ELMNA
Thiamine Ion SCHEMBL7200449 0.99 HSP90AA1 (0.95) HSP90AA1TKTTDP1KDM4ELMNA
Thiamine Ion SCHEMBL5189557 0.99 HSP90AA1 (0.95) HSP90AA1TKTTDP1KDM4ELMNA
Thiamine Ion SCHEMBL10636119 0.99 HSP90AA1 (0.95) HSP90AA1TKTTDP1KDM4ELMNA
Thiamine Ion SCHEMBL9618672 0.99 HSP90AA1 (0.95) HSP90AA1TKTTDP1KDM4ELMNA

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

Appears in 116922 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260144771-A1 Use of Triheptanoin Oil for Primary-Specific Pyruvate Dehydrogenase Complex (PDC) Deficiency UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2026-05-28 US claimed
US-20260144835-A1 MULTIFUNCTIONAL NUTRACEUTICAL FOR ENHANCING FEMALE HEALTH Beltran, Robert R. (US) 2026-05-28 US claimed
US-20260144836-A1 NUTRACEUTICAL FOR ENHANCED COGNITIVE PERFORMANCE Herbanized Wellness, LLC (US) 2026-05-28 US claimed
EP-4747627-A1 METHODS AND SYSTEMS FOR PREDICTIVE CLASSIFICATION BY MASS SPECTROMETRY AND TRAINED LARGE SPECTRAL MODELS Matterworks Inc (US) 2026-05-27 EP claimed
CN-122074633-A Flavour composition, aqueous food composition containing said flavour composition, preparation and use thereof 2026-05-26 CN claimed
CN-122087604-A Pear variety classification method and system based on minimum feature component diversity 2026-05-26 CN claimed
CN-119702255-B Technology for recovering apatite by floatation of iron tailings ANHUI MAGANG LUOHE MINE Co.,Ltd. (CN) 2026-05-26 CN claimed
CN-122074613-A Bergamot effervescent tablet based on microencapsulation inclusion technology and preparation method thereof 2026-05-26 CN claimed
CN-122094368-A Antimony-based solar cell and preparation method thereof 2026-05-26 CN claimed
US-12635714-B2 Compositions and methods for providing a health benefit to a growing animal Société des Produits Nestlé S.A. (CH) 2026-05-26 US claimed
US-4042698-A Treatment of myasthenia gravis and oral medication therefor ZAPPIA JOSEPH FRANCIS 1977-08-16 US claimed
US-4006219-A Composition and method for countering effects of alcohol consumption CERES PHARMACAL COMPANY (US) 1977-02-01 US claimed
US-4000322-A BLENDING, HONEY GERBER PRODUCTS COMPANY (US) 1976-12-28 US claimed
US-3997399-A CANDIDA LIPOLYTIC YEAST INSTITUT FRANCAIS DU PETROLE, DES CARBURANTS ET LUBRIFIANTS ET ENTREPRISE DE RECHERCHES ET D'ACTIVITIES PETROLIERES ELF (FR) 1976-12-14 US claimed
US-3993543-A Process for producing pyruvic acid by fermentation AJINOMOTO CO., INC. (JA) 1976-11-23 US claimed
US-3992555-A METABOLIZABLE FAT, VITAMINS, AND IRON COMPOUNDS VITAMINS, INC. (US) 1976-11-16 US claimed
US-3980523-A HAEMOPHILIUS GALLINARUM, SODIUM CHLORIDE, REDUCED NICOTINAMIDE ADENINE DINUCLEOTIDE RIMLER RICHARD B 1976-09-14 US claimed
US-3966988-A Flavoring compositions and processes utilizing dithiazine compounds INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1976-06-29 US claimed
US-3954979-A THIAMINE, RIBOFLAVIN, NIACIN, DEHYDRATION, PASTEURIZATION CERES PRODUCTS COMPANY, INC. (US) 1976-05-04 US claimed
US-3946115-A GRINDING, EXTRUSION RALSTON PURINA COMPANY (US) 1976-03-23 US claimed