Sulfuric Acid

Sulfuric Acid

SCHEMBL4276084

CN1C=NC=CC1.O=S(=O)(O)O

nearest known ligand 0.00

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Known targets — ChEMBL curated mechanism

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

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

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Sulfuric Acid SCHEMBL4983314 0.75
SCHEMBL1507720 0.72
Sulfuric Acid SCHEMBL29167862 0.65
SCHEMBL661922 0.58
SCHEMBL580176 0.58
Sulfuric Acid SCHEMBL8471322 0.55 CYP1A2 (0.48)
Sulfuric Acid SCHEMBL29275311 0.51
Sulfuric Acid SCHEMBL29131639 0.51
Sulfuric Acid SCHEMBL17311240 0.51 CA5A (0.75)
Sulfuric Acid SCHEMBL21173664 0.51 CA5A (0.75)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112694453-B Preparation method of N-methylated nitrogen-containing aromatic heterocyclic compound 中国科学院长春应用化学研究所 2022-09-06 CN disclosed
CN-112694453-A Preparation method of N-methylated nitrogen-containing aromatic heterocyclic compound 中国科学院长春应用化学研究所 2021-04-23 CN disclosed
US-7615644-B2 catalytic producing methanol from methane gas, by bubbling methane through the oxidation catalyst liquid mixture containing an imidazolium ionic liquid catalyst and a dissolved platinum compound as PtCl2, PtCl4, PtO2; cost efficiency, energy efficiency, low pollution, environmentally friendly CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2009-11-10 US disclosed
US-20060069169-A1 Use of ionic liquids as coordination ligands for organometallic catalysts CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2006-03-30 US disclosed
WO-2006033990-A2 USE OF IONIC LIQUIDS AS COORDINATION LIGANDS FOR ORGANOMETALLIC CATALYSTS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2006-03-30 WO disclosed