Sulfuric Acid

Sulfuric Acid

SCHEMBL4007080

CCCCC(CC)COCC[O].O=S(=O)(O)O

nearest known ligand 0.56

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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
CYP3A4 P08684 6/20 0.56
MMP9 P14780 1/20 0.50
MMP8 P22894 1/20 0.50
MMP14 P50281 1/20 0.50
RECQL P46063 1/20 0.49
TSHR P16473 4/20 0.46
TDP1 Q9NUW8 2/20 0.46
ATM Q13315 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ALDH1A1 P00352 7/20 0.44
NCOA1 Q15788 1/20 0.41
NCOA3 Q9Y6Q9 1/20 0.41
CA2 P00918 3/20 0.41
LMNA P02545 2/20 0.38
TP53 P04637 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36

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
SCHEMBL1396014 0.91 CYP3A4 (0.65) CYP3A4MMP9MMP8MMP14RECQL
Sulfuric Acid SCHEMBL124927 0.89 CYP3A4 (0.54) CYP3A4MMP9MMP8MMP14RECQL
Sulfuric Acid SCHEMBL25300462 0.88 RECQL (0.55) CYP3A4MMP9MMP8MMP14RECQL
Sulfuric Acid SCHEMBL4925238 0.87 CYP3A4 (0.56) CYP3A4MMP9MMP8MMP14RECQL
Sulfuric Acid SCHEMBL28669372 0.86 RECQL (0.54) CYP3A4MMP9MMP8MMP14RECQL
Sulfuric Acid SCHEMBL30386330 0.86 RECQL (0.54) CYP3A4MMP9MMP8MMP14RECQL
Sulfuric Acid SCHEMBL4916289 0.84 CYP3A4 (0.53) CYP3A4MMP9MMP8MMP14RECQL
Sulfuric Acid SCHEMBL4920694 0.84 CYP3A4 (0.53) CYP3A4MMP9MMP8MMP14RECQL
Sulfuric Acid SCHEMBL4925304 0.84 CYP3A4 (0.53) CYP3A4MMP9MMP8MMP14RECQL
Sulfuric Acid SCHEMBL4925474 0.84 CYP3A4 (0.53) CYP3A4MMP9MMP8MMP14RECQL

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-1834766-B1 Lithographic printing plate precursor FUJIFILM CORP (JP) 2009-06-17 EP disclosed
EP-1834766-A2 Lithographic printing plate precursor FUJIFILM Corporation (JP) 2007-09-19 EP disclosed