Sulfuric Acid

Sulfuric Acid

SCHEMBL9763324

CCCCCCC[N+](CC)(CCCCCCC)CCCCCCC.O=S(=O)(O)O

nearest known ligand 0.65

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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 16)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 5/20 0.65
SLC22A1 O15245 3/20 0.59
ALDH1A1 P00352 1/20 0.56
TP53 P04637 1/20 0.56
CYP3A4 P08684 1/20 0.56
ALOX15 P16050 1/20 0.56
TSHR P16473 1/20 0.56
ALOX12 P18054 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
HIF1A Q16665 1/20 0.56
HSD17B10 Q99714 1/20 0.56
SLC22A2 O15244 1/20 0.55
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
HSP90AA1 P07900 1/20 0.43
RAD52 P43351 1/20 0.43

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 SCHEMBL11672412 0.95 DNM1 (0.65) DNM1SLC22A1ALDH1A1TP53CYP3A4
Sulfuric Acid SCHEMBL27417097 0.95 DNM1 (0.73) DNM1SLC22A1ALDH1A1TP53CYP3A4
Sulfuric Acid SCHEMBL28271615 0.93 DNM1 (0.68) DNM1SLC22A1ALDH1A1TP53CYP3A4
Sulfuric Acid SCHEMBL11344204 0.93 SLC22A1 (0.68) DNM1SLC22A1ALDH1A1TP53CYP3A4
Sulfuric Acid SCHEMBL2320657 0.93 SLC22A1 (0.68) DNM1SLC22A1ALDH1A1TP53CYP3A4
Tetrahexylammonium SCHEMBL4146127 0.93 SLC22A1 (0.68) DNM1SLC22A1ALDH1A1TP53CYP3A4
Sulfuric Acid SCHEMBL781882 0.91 DNM1 (0.60) DNM1SLC22A1ALDH1A1TP53CYP3A4
Sulfuric Acid SCHEMBL6258594 0.91 DNM1 (0.60) DNM1SLC22A1ALDH1A1TP53CYP3A4
Sulfuric Acid SCHEMBL6259143 0.91 DNM1 (0.60) DNM1SLC22A1ALDH1A1TP53CYP3A4
Sulfuric Acid SCHEMBL17102695 0.91 SLC22A1 (0.52) DNM1SLC22A1ALDH1A1TP53CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5021528-A Crosslinked bisphenol containing arylcyclobutene alkyl ethers and cured compositions therefrom SHELL OIL COMPANY (US) 1991-06-04 US disclosed
US-4943665-A Modified bisphenols containing arylcyclobutenealkyl ethers and cured compositions therefrom SHELL OIL COMPANY (US) 1990-07-24 US disclosed