Sulfuric Acid

Sulfuric Acid

SCHEMBL4270871

Cc1nc(C)c(C)o1.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 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.36
HSD17B10 Q99714 6/20 0.34
HPGD P15428 2/20 0.34
SMN1; SMN2 Q16637 4/20 0.33
HTT P42858 3/20 0.33
LMNA P02545 3/20 0.33
TSHR P16473 2/20 0.33
USP2 O75604 2/20 0.33
POLB P06746 2/20 0.33
MAPT P10636 2/20 0.33
HSD11B1 P28845 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL76903 0.84
SCHEMBL7682851 0.67 HSD11B1 (0.33) HSD11B1
SCHEMBL5536771 0.64
SCHEMBL11443223 0.64
SCHEMBL21688713 0.62 SMN1; SMN2 (0.38) ALDH1A1HSD17B10HPGDSMN1; SMN2LMNA
SCHEMBL22824386 0.60
Sulfuric Acid SCHEMBL4275195 0.60 CA5A (0.38) ALDH1A1HSD17B10HPGDSMN1; SMN2HTT
SCHEMBL962147 0.58
Sulfuric Acid SCHEMBL10523312 0.58 CA5A (0.86) ALDH1A1LMNATSHRMEN1KMT2A
Sulfuric Acid SCHEMBL20597917 0.58 CA5A (0.86) ALDH1A1LMNATSHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7615644-B2 catalytic producing methanol from methane gas, by bubbling methane through the oxidation catalyst liquid mixture containing an imidazolium ionic liquid catalyst and a dissolved platinum compound as PtCl2, PtCl4, PtO2; cost efficiency, energy efficiency, low pollution, environmentally friendly CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2009-11-10 US disclosed
US-20060069169-A1 Use of ionic liquids as coordination ligands for organometallic catalysts CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2006-03-30 US disclosed
WO-2006033990-A2 USE OF IONIC LIQUIDS AS COORDINATION LIGANDS FOR ORGANOMETALLIC CATALYSTS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2006-03-30 WO disclosed