Sulfuric Acid

Sulfuric Acid

SCHEMBL3399748

C=CCn1c(C)cc(C)[n+](C)c1=O.O=S(=O)([O-])O

nearest known ligand 0.40

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 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.40
KDM4E B2RXH2 3/20 0.40
HPGD P15428 2/20 0.40
MEN1 O00255 2/20 0.40
SMN1; SMN2 Q16637 6/20 0.35
ALDH1A1 P00352 5/20 0.35
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
CYP3A4 P08684 2/20 0.35
TP53 P04637 1/20 0.35
CYP2C19 P33261 1/20 0.35
MAPT P10636 4/20 0.34
THRB P10828 1/20 0.34
BLM P54132 1/20 0.34
HSD17B10 Q99714 1/20 0.34
RCE1 Q9Y256 1/20 0.34
MITF O75030 2/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL1426816 0.90 KMT2A (0.46) KMT2AKDM4EHPGDMEN1SMN1; SMN2
Bromide SCHEMBL1457139 0.88 KMT2A (0.45) KMT2AKDM4EHPGDMEN1SMN1; SMN2
Hydrochloric Acid SCHEMBL4088358 0.88 KMT2A (0.45) KMT2AKDM4EHPGDMEN1SMN1; SMN2
Sulfuric Acid SCHEMBL3400219 0.80 HSD17B10 (0.41) KMT2AKDM4EMEN1ALDH1A1MAPT
Sulfuric Acid SCHEMBL1457606 0.74
SCHEMBL1426641 0.69 HSD17B10 (0.47) KMT2AKDM4EMEN1ALDH1A1MAPT
SCHEMBL3118058 0.69 ALDH1A1 (0.36) KMT2AKDM4EMEN1SMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL4605053 0.68 HSD17B10 (0.46) KMT2AKDM4EMEN1ALDH1A1MAPT
SCHEMBL1830280 0.68 KDM4E (0.31) KMT2AKDM4EHPGDMEN1
SCHEMBL3118165 0.67 MAPT (0.50) KMT2AKDM4EHPGDMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2044977-B1 Hair dye with oxidative pre-treatment HENKEL AG & CO KGAA (DE) 2018-02-14 EP disclosed
EP-1944010-B1 Brightening and/or colouring agent with acrylic acid derivative(s) HENKEL AG & CO KGAA (DE) 2015-03-11 EP 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
EP-2196184-A1 Hair dye with colour indicator Henkel AG & Co. KGaA (DE) 2010-06-16 EP disclosed
EP-2081543-A2 BLEACHING AGENT COMPRISING PIPERIDONE/S AND IMIDAZOLE/S Henkel AG & Co. KGaA (DE) 2009-07-29 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
EP-2044977-A2 Hair dye with oxidative pre-treatment Henkel AG & Co. KGaA (DE) 2009-04-08 EP disclosed
EP-1972323-A2 Hair colorant Henkel AG & Co. KGaA (DE) 2008-09-24 EP disclosed
WO-2008095558-A2 BLEACHING AGENT COMPRISING PIPERIDONE/S AND IMIDAZOLE/S HENKEL AG & CO. KGAA (DE) 2008-08-14 WO disclosed
EP-1944010-A2 Brightening and/or colouring agent with acrylic acid derivative(s) Henkel AG & Co. KGaA (DE) 2008-07-16 EP disclosed