Sulfuric Acid

Sulfuric Acid

SCHEMBL4557083

C=CCC(N)CCN.O=S(=O)(O)O

nearest known ligand 0.33

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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 9)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.33
GRIK2 Q13002 2/20 0.33
TP53 P04637 1/20 0.31
LMNA P02545 1/20 0.31
SLC6A6 P31641 1/20 0.31
CYP2C19 P33261 1/20 0.31
BLM P54132 1/20 0.31
GABBR2 O75899 1/20 0.30
GABBR1 Q9UBS5 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
SCHEMBL175675 0.87
Hydrochloric Acid SCHEMBL6288816 0.84 ALDH1A1 (0.33) GRIK1GRIK2
Sulfuric Acid SCHEMBL5169847 0.84 GRIK1 (0.39) GRIK1GRIK2TP53
Hydrochloric Acid SCHEMBL6531379 0.84
Sulfuric Acid SCHEMBL28879549 0.84 GRIK1 (0.39) GRIK1GRIK2TP53
Fluoride SCHEMBL28175113 0.84 ALDH1A1 (0.33) GRIK1GRIK2
Acetic Acid SCHEMBL859882 0.82 GRIK1 (0.40) GRIK1GRIK2CYP2C19BLMGABBR2
Sulfuric Acid SCHEMBL14836674 0.81 LMNA (0.32) GRIK1GRIK2LMNASLC6A6CYP2C19
SCHEMBL14837155 0.76 GRIK1 (0.36) GRIK1GRIK2TP53
SCHEMBL355298 0.75 LMNA (0.31) LMNASLC6A6CYP2C19BLMGABBR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4155855-A INCLUDING FABRIC SUBSTANTIVE AGENT; STORAGE STABILITY THE PROCTER & GAMBLE COMPANY (US) 1979-05-22 US claimed
EP-0000406-A1 Concentrated liquid fabric softener containing mixed active system Procter & Gamble European Technical Center (BE) 1979-01-24 EP claimed
EP-1922397-B1 FABRIC CONDITIONING COMPOSITION UNILEVER PLC (GB) 2013-12-25 EP disclosed
US-20090036346-A1 Fabric Conditioning Composition Henkel IP & Holding GmbH (DE) 2009-02-05 US disclosed
EP-1922397-A1 FABRIC CONDITIONING COMPOSITION Unilever Plc (GB) 2008-05-21 EP disclosed
WO-2007028495-A1 FABRIC CONDITIONING COMPOSITION UNILEVER PLC (GB) 2007-03-15 WO disclosed
EP-0018039-B2 FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1988-08-24 EP disclosed
EP-0043622-B1 FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1984-11-21 EP disclosed
EP-0018039-B1 FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1984-03-07 EP disclosed
US-4386000-A IMPROVED VISCOSITY AND STABILITY THE PROCTER & GAMBLE COMPANY (US) 1983-05-31 US disclosed
EP-0043622-A1 Fabric softening composition THE PROCTER & GAMBLE COMPANY (US) 1982-01-13 EP disclosed
EP-0018039-A1 Fabric softening composition THE PROCTER & GAMBLE COMPANY (US) 1980-10-29 EP disclosed
US-4155855-A INCLUDING FABRIC SUBSTANTIVE AGENT; STORAGE STABILITY THE PROCTER & GAMBLE COMPANY (US) 1979-05-22 US disclosed
US-4149978-A CATIONIC FABRIC SOFTENER AND A HYDROCARBON THE PROCTER & GAMBLE COMPANY (US) 1979-04-17 US disclosed
EP-0000406-A1 Concentrated liquid fabric softener containing mixed active system Procter & Gamble European Technical Center (BE) 1979-01-24 EP disclosed