Sulfuric Acid

Sulfuric Acid

SCHEMBL9815241

CC[N+](C)(CC)c1ccccc1.O=S(=O)([O-])O

nearest known ligand 0.38

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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 19)

geneUniProtsupporting neighboursconfidence
PSIP1 O75475 1/20 0.38
APOBEC3A P31941 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
PTGS2 P35354 1/20 0.37
TSHR P16473 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
ACHE P22303 3/20 0.35
OPRM1 P35372 1/20 0.35
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
BLM P54132 1/20 0.34
CA12 O43570 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
HSD11B1 P28845 1/20 0.34

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
SCHEMBL5436496 0.83 APOBEC3A (0.50) PSIP1APOBEC3AAPOBEC3GTSHRSMN1; SMN2
Sulfuric Acid SCHEMBL10802033 0.82 PSIP1 (0.39) PSIP1APOBEC3AAPOBEC3GPTGS2TSHR
Sulfuric Acid SCHEMBL1508282 0.82 PSIP1 (0.39) PSIP1PTGS2TSHRSMN1; SMN2CES2
Water SCHEMBL8385260 0.81 APOBEC3A (0.48) PSIP1APOBEC3AAPOBEC3GTSHRSMN1; SMN2
Sulfuric Acid SCHEMBL5345728 0.79 APOBEC3A (0.61) APOBEC3AAPOBEC3GTSHRSMN1; SMN2ACHE
Sulfuric Acid SCHEMBL27613503 0.76 APOBEC3A (0.56) APOBEC3AAPOBEC3GTSHRSMN1; SMN2ACHE
SCHEMBL5463391 0.75 APEX1 (0.40) PSIP1APOBEC3AAPOBEC3GKDM4EALDH1A1
Sulfuric Acid SCHEMBL31286303 0.74 PSIP1 (0.41) PSIP1APOBEC3AAPOBEC3GACHECES2
SCHEMBL331964 0.74 PSIP1 (0.41) PSIP1APOBEC3AAPOBEC3GACHECES2
SCHEMBL331965 0.74 PSIP1 (0.41) PSIP1APOBEC3AAPOBEC3GTSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0269884-B1 CATALYZED ALKYLATION OF HALOPYRIDINATES IN THE ABSENCE OF ADDED ORGANIC SOLVENTS DOWELANCO (US) 1991-09-25 EP disclosed
EP-0277292-B1 ORGANIC SOLVENT-FREE PROCESS FOR PREPARING PYRIMIDINYL ORGANOPHOSPHATES THE DOW CHEMICAL COMPANY (US) 1991-05-08 EP disclosed
EP-0277292-A1 Organic solvent-free process for preparing pyrimidinyl organophosphates THE DOW CHEMICAL COMPANY (US) 1988-08-10 EP disclosed
EP-0269884-A1 Catalyzed alkylation of halopyridinates in the absence of added organic solvents DOWELANCO (US) 1988-06-08 EP disclosed
US-4701531-A Catalyzed alkylation of halopyridinates in the absence of added organic solvents THE DOW CHEMICAL COMPANY (US) 1987-10-20 US disclosed
US-4546189-A Preparation of cyano(6-(substituted phenoxy)-2-pyridinyl)methyl esters of 3-(2,2-dihaloethenyl)-2,2-dimethylcyclopropane carboxylic acids THE DOW CHEMICAL COMPANY (US) 1985-10-08 US disclosed
EP-0010891-B1 HETEROCYCLIC SUBSTITUTED TRIAZOLYL PHOSPHOROUS COMPOUNDS, INSECTICIDAL COMPOSITIONS CONTAINING THEM AND METHOD FOR CONTROLLING INSECTS THE DOW CHEMICAL COMPANY (US) 1982-09-01 EP disclosed
EP-0050846-A1 Preparation of cyano (6-(substituted phenoxy)-2-pyridinyl) methyl esters of 3-(2,2-dihaloethenyl)-2,2-dimethyl cyclopropane carboxylic acids THE DOW CHEMICAL COMPANY (US) 1982-05-05 EP disclosed
US-4224318-A INSECTICIDES THE DOW CHEMICAL COMPANY (US) 1980-09-23 US disclosed
US-4223025-A INSECTICIDES THE DOW CHEMICAL COMPANY (US) 1980-09-16 US disclosed
EP-0010891-A1 Heterocyclic substituted triazolyl phosphorous compounds, insecticidal compositions containing them and method for controlling insects THE DOW CHEMICAL COMPANY (US) 1980-05-14 EP disclosed
US-4147866-A Process for preparing phosphorothioates and phenylphosphonothioates THE DOW CHEMICAL COMPANY (US) 1979-04-03 US disclosed
US-4096210-A REACTING ALKALI METAL PHENATE, PYRIDINATE OR PYRIMIDATE WITH O,O-DIALKYLPHOSPHOROCHLORIDOTHIOATE OR O-ALKYL PHENYLPHOSPHONOCHLORIDOTHIOATE THE DOW CHEMICAL COMPANY (US) 1978-06-20 US disclosed
US-4007197-A QUATERNARY AMMONIUM OR PHOSPHONIUM SALT AND TERTIARY AMINE CATALYST THE DOW CHEMICAL COMPANY (US) 1977-02-08 US disclosed