Sulfuric Acid

Sulfuric Acid

SCHEMBL9526264

CCCc1cc(NCCNS(C)(=O)=O)ccc1N.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
MAPT P10636 5/20 0.36
KDM4D Q6B0I6 1/20 0.36
GRIN1 Q05586 3/20 0.33
GRIN2B Q13224 3/20 0.33
KCNH2 Q12809 2/20 0.33
GAA P10253 1/20 0.33
SIRT5 Q9NXA8 1/20 0.33
POLB P06746 3/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PKM P14618 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
LMNA P02545 1/20 0.33
NQO2 P16083 1/20 0.32
ATM Q13315 1/20 0.32
CYP2C9 P11712 1/20 0.31
TDO2 P48775 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 1/20 0.31

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
SCHEMBL8862006 0.95 MAPT (0.39) MAPTKDM4DGRIN1GRIN2BKCNH2
Sulfuric Acid SCHEMBL9569292 0.90 MAPT (0.39) MAPTKDM4DGRIN1GRIN2BKCNH2
SCHEMBL10336738 0.85 MAPT (0.41) MAPTKDM4DGRIN1GRIN2BKCNH2
Sulfuric Acid SCHEMBL9416322 0.84 ALDH1A1 (0.37) MAPTGAAPOLBPKMCTDSP1
SCHEMBL10408987 0.83 NQO2 (0.41) MAPTKDM4DGRIN1GRIN2BKCNH2
Hydrochloric Acid SCHEMBL9191787 0.82 NQO2 (0.40) MAPTKDM4DGRIN1GRIN2BKCNH2
Sulfuric Acid SCHEMBL11318250 0.82 ALDH1A1 (0.41) MAPTKDM4DGRIN1GRIN2BKCNH2
Sulfuric Acid SCHEMBL7031463 0.82 ALDH1A1 (0.41) MAPTKDM4DGRIN1GRIN2BKCNH2
Sulfuric Acid SCHEMBL3453574 0.80 ALDH1A1 (0.42) MAPTKDM4DGRIN1GRIN2BKCNH2
SCHEMBL8518280 0.77 ALDH1A1 (0.38) GAAPOLBLMNAKDM4EHSD17B10

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
EP-0521019-A1 PYRAZOLO 1,5-a]BENZIMIDAZOLE PHOTOGRAPHIC COLOUR COUPLERS KODAK LIMITED (GB) 1993-01-07 EP disclosed
EP-0469046-A1 METHOD OF FORMING A PHOTOGRAPHIC COLOUR IMAGE. KODAK LTD (GB) 1992-02-05 EP disclosed
EP-0460008-A1 THE USE OF PYRAZOLO-TRIAZOLE PHOTOGRAPHIC COLOUR COUPLERS. KODAK LTD (GB) 1991-12-11 EP disclosed
WO-1990013061-A1 METHOD OF FORMING A PHOTOGRAPHIC COLOUR IMAGE KODAK LIMITED (GB) 1990-11-01 WO disclosed
WO-1990010253-A1 THE USE OF PYRAZOLO-TRIAZOLE PHOTOGRAPHIC COLOUR COUPLERS KODAK LIMITED (GB) 1990-09-07 WO disclosed