Sulfuric Acid

Sulfuric Acid

SCHEMBL3650815

O=S(=O)(O)O.[N-]=[N+]=[N-].[Na+]

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 SCHEMBL3650810 1.00 CA5A (0.55) —
Sulfuric Acid SCHEMBL16448274 1.00 CA5A (0.55) —
Sulfuric Acid SCHEMBL28642679 1.00 CA5A (0.55) —
Sulfuric Acid SCHEMBL2840688 0.95 — —
Sulfuric Acid SCHEMBL30712828 0.85 — —
Sulfuric Acid SCHEMBL9546784 0.84 CA5A (0.46) —
Sulfuric Acid SCHEMBL31464825 0.80 — —
Sulfuric Acid SCHEMBL11574785 0.80 CA5A (0.86) —
Sulfuric Acid SCHEMBL10744664 0.80 CA5A (0.86) —
Sulfuric Acid SCHEMBL11443708 0.80 CA5A (0.86) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8227492-B2 Sulfoxamine derivatives as factor Xa inhibitors CADILA HEALTHCARE LIMITED (IN) 2012-07-24 — — US disclosed
US-20110065717-A1 SULFOXIMINE DERIVATIVES AS FACTOR XA INHIBITORS CADILA HEALTHCARE LIMITED (IN) 2011-03-17 — — US disclosed
EP-2188257-A2 SULFOXIMINE DERIVATIVES AS FACTOR XA INHIBITORS Cadila Healthcare Limited (IN) 2010-05-26 — — EP disclosed
WO-2009053999-A2 SULFOXIMINE DERIVATIVES AS FACTOR XA INHIBITORS CADILA HEALTHCARE LIMITED (IN) 2009-04-30 — — WO disclosed
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