Sulfuric Acid

Sulfuric Acid

SCHEMBL5278587

Nc1c(N=O)cnn1CCO.O=S(=O)([O-])O.[H+]

nearest known ligand 0.30

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 1)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 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 SCHEMBL5278578 0.93 CYP1A2 (0.33) CYP1A2
SCHEMBL1436714 0.89 CYP1A2 (0.36) CYP1A2
Hydrochloric Acid SCHEMBL6760437 0.78
SCHEMBL15198091 0.73 POLB (0.41)
Sulfuric Acid SCHEMBL2854050 0.73 CYP1A2 (0.36) CYP1A2
Sulfuric Acid SCHEMBL8919999 0.72 CYP1A2 (0.35) CYP1A2
SCHEMBL8921624 0.68 MEN1 (0.40) CYP1A2
SCHEMBL14384185 0.68 FSCN1 (0.31)
SCHEMBL33881 0.67 CYP1A2 (0.42) CYP1A2
Hydrochloric Acid SCHEMBL10338723 0.67 MEN1 (0.39)

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-1408025-B1 3,3-DIALKOXY-2-HYDROXYIMINOPROPIONITRILES, PROCESS FOR PREPARATION THEREOF AND PROCESS OF PREPARING 5-AMINO -4-NITROSOPYRAZOLES OR SALTS THEREOF BY THE USE OF THE SAME UBE INDUSTRIES (JP) 2007-11-21 EP disclosed
US-7227032-B2 3,3-dialkoxy-2-hydroxyiminopropionitriles, process for preparation thereof and process of preparing 5-amino-4-nitrosopyrazoles or salts thereof by the use of the same UBE INDUSTRIES, LTD. (JP) 2007-06-05 US disclosed
US-20040116732-A1 3,3-Dialkoxy-2-hydroxyiminopropionitriles, process for preparation thereof and process of preparing 5-amino-4-nitrosopyrazoles or salts thereof by the use of the same UBE INDUSTRIES, LTD. (JP) 2004-06-17 US disclosed
EP-1408025-A1 3,3-DIALKOXY-2-HYDROXYIMINOPROPIONITRILES, PROCESS FOR PREPARATION THEREOF AND PROCESS OF PREPARING 5-AMINO -4-NITROSOPYRAZOLES OR SALTS THEREOF BY THE USE OF THE SAME Ube Industries, Ltd. (JP) 2004-04-14 EP disclosed