Sulfuric Acid

Sulfuric Acid

SCHEMBL3653103

CCc1c[nH]c(=S)[n+](CC)c1C.O=S(=O)([O-])O

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CYP51cyp51Acyp51c

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 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 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 SCHEMBL3401199 0.61 KDM4E (0.33) KDM4ELMNAKMT2A
Sulfuric Acid SCHEMBL28470571 0.60
Sulfuric Acid SCHEMBL11235635 0.59
Sulfuric Acid SCHEMBL21195059 0.57 HTT (0.42) ALDH1A1KDM4ELMNAKMT2A
Sulfuric Acid SCHEMBL1552980 0.55
Sulfuric Acid SCHEMBL6657 0.53
Sulfuric Acid SCHEMBL28501412 0.53 TSHR (0.80) ALDH1A1KDM4ELMNAKMT2ATDP1
Sulfuric Acid SCHEMBL8192555 0.53 TSHR (0.80) ALDH1A1KDM4ELMNAKMT2ATDP1
SCHEMBL9423160 0.53 GRIN2D (0.31) KMT2ATDP1
Sulfuric Acid SCHEMBL28001380 0.52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2673267-A1 1,3-DIOXAN-5-ONE COMPOUNDS Merck Patent GmbH (DE) 2013-12-18 EP disclosed
WO-2012107158-A1 1,3-DIOXAN-5-ONE COMPOUNDS MERCK PATENT GMBH (DE) 2012-08-16 WO disclosed
EP-2200735-A1 METHOD FOR THE CONTINUOUS PRODUCTION OF COLORING AGENTS FOR KERATINIC FIBERS Henkel AG & Co. KGaA (DE) 2010-06-30 EP disclosed
WO-2009053127-A1 METHOD FOR THE CONTINUOUS PRODUCTION OF COLORING AGENTS FOR KERATINIC FIBERS HENKEL AG & CO. KGAA (DE) 2009-04-30 WO disclosed