Sulfuric Acid

Sulfuric Acid

SCHEMBL6705350

Nc1ccc(F)cc1F.O=S(=O)(O)O

nearest known ligand 0.74

Full drug profile on Sugi Atlas →

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 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.74
CA9 Q16790 3/20 0.53
CA6 P23280 2/20 0.53
CA5A P35218 2/20 0.53
CA14 Q9ULX7 2/20 0.53
CA5B Q9Y2D0 2/20 0.53
CA12 O43570 2/20 0.53
CA1 P00915 2/20 0.53
CA2 P00918 2/20 0.53
CA4 P22748 1/20 0.53
CA7 P43166 1/20 0.53
KEAP1 Q14145 1/20 0.48
HDAC1 Q13547 4/20 0.44
HDAC6 Q9UBN7 1/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
PKM P14618 1/20 0.44
RAB9A P51151 1/20 0.44

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 SCHEMBL34463729 1.00 ALDH1A1 (0.74) ALDH1A1CA9CA6CA5ACA14
SCHEMBL11425 0.86
SCHEMBL29595875 0.86
Fluoride SCHEMBL29165726 0.84 ALDH1A1 (0.94) ALDH1A1CA9CA6CA5ACA14
Hydrochloric Acid SCHEMBL3851075 0.84 ALDH1A1 (0.94) ALDH1A1CA9CA6CA5ACA14
Hydrochloric Acid SCHEMBL7125109 0.84 ALDH1A1 (0.94) ALDH1A1CA9CA6CA5ACA14
Methane SCHEMBL22289605 0.84 ALDH1A1 (0.94) ALDH1A1CA9CA6CA5ACA14
Formic Acid SCHEMBL28834640 0.83 ALDH1A1 (0.74) ALDH1A1CA9CA6CA5ACA14
Sulfuric Acid SCHEMBL8639591 0.83 ALDH1A1 (0.59) ALDH1A1CA9CA6CA5ACA14
Cyanide SCHEMBL27761725 0.79 ALDH1A1 (0.85) ALDH1A1CA9CA6CA5ACA14

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
US-20040077895-A1 Process for the preparation of strobilurin intermediates WADITSCHATKA RUDOLF (CH) 2004-04-22 US disclosed
US-6664422-B1 Process for the preparation of strobilurin intermediates BAYER AKTIENGESELLSCHAFT (DE) 2003-12-16 US disclosed
EP-1137627-A1 PROCESS FOR THE PREPARATION OF STROBILURIN INTERMEDIATES Bayer Aktiengesellschaft (DE) 2001-10-04 EP disclosed
WO-2000034229-A1 PROCESS FOR THE PREPARATION OF STROBILURIN INTERMEDIATES BAYER AKTIENGESELLSCHAFT (DE) 2000-06-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040077895-A1 Process for the preparation of strobilurin intermediates TET1, CYP1B1, STS ALDH1A1 573/4885CA9 208/4885CA6 130/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.