Sulfuric Acid

Sulfuric Acid

SCHEMBL29045867

CC(C)(C(N)=O)S(=O)(=O)O.O=S(=O)(O)O

nearest known ligand 0.36

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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.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 3/20 0.36
KDM4E B2RXH2 2/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CA5A P35218 2/20 0.33
CA5B Q9Y2D0 2/20 0.33
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ALOX15 P16050 2/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
TSHR P16473 1/20 0.30
NT5E P21589 1/20 0.30
CA4 P22748 1/20 0.30
CA6 P23280 1/20 0.30
CA7 P43166 1/20 0.30
CA9 Q16790 1/20 0.30
LMNA P02545 1/20 0.30
PMP22 Q01453 1/20 0.30

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
SCHEMBL3989015 0.97 BLM (0.32) BLMKDM4ECYP2D6CYP2C19NPSR1
SCHEMBL28217967 0.94 BLM (0.31) BLMKDM4ECYP2D6CYP2C19NPSR1
Sulfuric Acid SCHEMBL6263301 0.77 TSHR (0.42) BLMKDM4ECYP2D6CYP2C19NPSR1
SCHEMBL23199767 0.74 CA1 (0.32) BLMALOX15CA1LMNAPMP22
SCHEMBL18498735 0.72 BLM (0.31) BLMKDM4ECYP2D6CYP2C19NPSR1
Pivalamide SCHEMBL7280681 0.71 CA2 (0.35) BLMKDM4ECYP2D6CYP2C19NPSR1
SCHEMBL1169404 0.71 ALDH1A1 (0.33) ALDH1A1L3MBTL1ALOX15
SCHEMBL866857 0.71 ALDH1A1 (0.46) CYP2D6CYP2C19ALDH1A1L3MBTL1ALOX15
SCHEMBL27768757 0.69 TSHR (0.40) BLMKDM4ECYP2D6CYP2C19NPSR1
SCHEMBL8574238 0.69 CA2 (0.33) BLMKDM4ECYP2D6CYP2C19NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116490489-A Method for producing Methacrylic Acid (MAS) and/or alkyl methacrylate optimized by reducing interfering byproducts 罗姆化学有限责任公司 2023-07-25 CN disclosed
CN-116490488-A Method for preparing alkyl methacrylate optimized by reducing interfering byproducts 罗姆化学有限责任公司 2023-07-25 CN disclosed
CN-116348444-A Improved process for the preparation of methyl methacrylate and/or methacrylic acid with reduced back mixing during conversion 罗姆化学有限责任公司 2023-06-27 CN disclosed