Sulfuric Acid

Sulfuric Acid

SCHEMBL8748996

C=O.O=S(=O)([O-])O.[Cu].[Na+]

nearest known ligand 0.00

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Known targets — ChEMBL curated mechanism

CYP51cyp51Acyp51c

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 SCHEMBL31319427 0.96 TSHR (0.82)
Sulfuric Acid SCHEMBL1200048 0.96
Sulfuric Acid SCHEMBL29017234 0.92 TSHR (0.75)
Sulfuric Acid SCHEMBL29291376 0.92 TSHR (0.75)
Sulfuric Acid SCHEMBL29066750 0.92 TSHR (0.75)
Sulfuric Acid SCHEMBL22528622 0.87
Sulfuric Acid SCHEMBL3375458 0.87
Sulfuric Acid SCHEMBL27312 0.87
Sulfuric Acid SCHEMBL2381067 0.87 TSHR (1.00)
Sulfuric Acid SCHEMBL27823566 0.87 TSHR (1.00)

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
EP-0754249-A1 USE OF A COMPOUND THE ASSOCIATED OCTEL COMPANY LIMITED (GB) 1997-01-22 EP disclosed
WO-1996015290-A1 USE OF A COMPOUND THE ASSOCIATED OCTEL COMPANY LIMITED (GB) 1996-05-23 WO disclosed