Sulfuric Acid

Sulfuric Acid

SCHEMBL28528641

O=S(=O)(O)CCCN1c2ccccc2SC1S.O=S(=O)(O)O

nearest known ligand 0.39

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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
▸ MEN1 O00255 6/20 0.39
▸ KMT2A Q03164 6/20 0.39
▸ MAPT P10636 6/20 0.39
▸ POLB P06746 5/20 0.39
▸ MMP13 P45452 4/20 0.39
▸ HPGD P15428 5/20 0.36
▸ ALOX15 P16050 4/20 0.36
▸ ALDH1A1 P00352 4/20 0.36
▸ TDP1 Q9NUW8 4/20 0.36
▸ ALOX12 P18054 3/20 0.36
▸ CASP1 P29466 3/20 0.36
▸ HSD17B10 Q99714 3/20 0.36
▸ CASP7 P55210 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ PKM P14618 1/20 0.36
▸ CTDSP1 Q9GZU7 2/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36
▸ MAPK1 P28482 3/20 0.35
▸ ALPG P10696 2/20 0.35
▸ L3MBTL1 Q9Y468 3/20 0.34

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
SCHEMBL28511883 0.99 MEN1 (0.40) MEN1KMT2AMAPTPOLBMMP13
SCHEMBL28523723 0.95 MAPT (0.37) MEN1KMT2AMAPTPOLBMMP13
SCHEMBL28515181 0.94 MAPT (0.38) MEN1KMT2AMAPTPOLBMMP13
SCHEMBL28522891 0.88 MAPT (0.37) MEN1KMT2AMAPTPOLBMMP13
SCHEMBL3326021 0.82 MEN1 (0.42) MEN1KMT2AMAPTPOLBMMP13
SCHEMBL15494050 0.79 MEN1 (0.40) MEN1KMT2AMAPTPOLBMMP13
SCHEMBL6834722 0.78 MEN1 (0.39) MEN1KMT2AMAPTPOLBMMP13
SCHEMBL3324713 0.78 MEN1 (0.38) MEN1KMT2AMAPTPOLBMMP13
SCHEMBL18779843 0.77 MAPT (0.37) MEN1KMT2AMAPTPOLBMMP13
SCHEMBL11547668 0.74 GSK3B (0.40) ALDH1A1LMNAKDM4EGSK3BCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108570019-B Acidic ionic liquid and catalytic application thereof 大连理工大学 2021-02-26 — — CN disclosed
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