Sulfuric Acid

Sulfuric Acid

SCHEMBL20573200

CC[N+](CC)(CC)CCCS(=O)(=O)O.O=S(=O)([O-])[O-].[H+]

nearest known ligand 0.42

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Known targets — ChEMBL curated mechanism

dacAdacBdacCftsImrcAmrcBmrdA

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
BBOX1 O75936 2/20 0.42
DNM1 Q05193 4/20 0.37
APP P05067 1/20 0.37
PTGS1 P23219 1/20 0.30
PDE4A P27815 1/20 0.30
LMNA P02545 1/20 0.30
SLC6A6 P31641 1/20 0.30
CYP2C19 P33261 1/20 0.30
BLM P54132 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
Sulfuric Acid SCHEMBL20573201 0.94 BBOX1 (0.44) BBOX1DNM1APPPTGS1PDE4A
SCHEMBL34922 0.92 BBOX1 (0.42) BBOX1DNM1APPPTGS1PDE4A
SCHEMBL9165215 0.92 DNM1 (0.42) BBOX1DNM1APPPTGS1PDE4A
Water SCHEMBL918201 0.90 DNM1 (0.41) BBOX1DNM1APPPTGS1PDE4A
SCHEMBL34923 0.88 DNM1 (0.39) BBOX1DNM1APPPTGS1PDE4A
SCHEMBL34816 0.86 DNM1 (0.40) BBOX1DNM1APPLMNACYP2C19
Trifluoromethanesulfonic Acid SCHEMBL34703 0.85 BBOX1 (0.38) BBOX1DNM1APP
SCHEMBL34652 0.85 DNM1 (0.46) BBOX1DNM1APPPTGS1PDE4A
SCHEMBL17991832 0.82 SLC22A1 (0.44) BBOX1DNM1APP
SCHEMBL8738943 0.82 DNM1 (0.38) BBOX1DNM1APPPTGS1PDE4A

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
EP-3097111-B1 NOVEL PROCESS FOR CONVERSION OF HEMICELLULOSE INTO C5 SUGARS USING IONIC LIQUIDS COUNCIL SCIENT IND RES (IN) 2018-12-05 EP disclosed