Sulfuric Acid

Sulfuric Acid

SCHEMBL867069

CS(C)(C)C.O=S(=O)(O)O

nearest known ligand 0.67

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
CA5A P35218 2/20 0.67
CA5B Q9Y2D0 2/20 0.67
KDM4E B2RXH2 3/20 0.50
CYP3A4 P08684 2/20 0.50
CA2 P00918 3/20 0.43
TSHR P16473 4/20 0.42
CA1 P00915 2/20 0.42
NT5E P21589 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
BLM P54132 2/20 0.40
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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 SCHEMBL7201060 0.89 CA5A (0.67) CA5ACA5BKDM4ECYP3A4CA2
Dimethyl Sulfone SCHEMBL16321746 0.89 KDM4E (0.67) CA5ACA5BKDM4ECYP3A4CA2
Sulfuric Acid SCHEMBL676741 0.89 CA5A (0.67) CA5ACA5BKDM4ECYP3A4CA2
Sulfuric Acid SCHEMBL17102613 0.89 CA5A (0.67) CA5ACA5BKDM4ECYP3A4CA2
Sulfuric Acid SCHEMBL28003070 0.84 CA5A (0.60) CA5ACA5BKDM4ECYP3A4CA2
Sulfuric Acid SCHEMBL4614990 0.84 CA5A (0.60) CA5ACA5BKDM4ECYP3A4CA2
SCHEMBL15109974 0.82
SCHEMBL25599 0.82 CA2 (0.58) CA5ACA5BKDM4ECYP3A4CA2
SCHEMBL105 0.82
Sulfuric Acid SCHEMBL17311240 0.82 CA5A (0.75) CA5ACA5BKDM4ECYP3A4CA2

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5466816-A Process for preparation of azolylmethylcycloalkanol derivatives KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) 1995-11-14 US claimed
EP-0655443-A2 Process for the preparation of azolylmethylcycloalkanol derivatives KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) 1995-05-31 EP claimed
US-20120108422-A1 Antifungal 1,2,4-triazolyl Derivatives BASF SE (DE) 2012-05-03 US disclosed
EP-2443098-A1 ANTIFUNGAL 1, 2, 4-TRIAZOLYL DERIVATIVES BASF SE (DE) 2012-04-25 EP disclosed
EP-2443099-A1 ANTIFUNGAL 1, 2, 4-TRIAZOLYL DERIVATIVES HAVING A 5- SULFUR SUBSTITUENT BASF SE (DE) 2012-04-25 EP disclosed
EP-2443097-A1 ANTIFUNGAL 1, 2, 4-TRIAZOLYL DERIVATIVES BASF SE (DE) 2012-04-25 EP disclosed
EP-2440535-A1 ANTIFUNGAL 1,2,4-TRIAZOLYL DERIVATIVES HAVING A 5- SULFUR SUBSTITUENT BASF SE (DE) 2012-04-18 EP disclosed
US-20120088660-A1 Antifungal 1,2,4-triazolyl Derivatives BASF SE (DE) 2012-04-12 US disclosed
US-20120088664-A1 Antifungal 1,2,4-triazolyl derivatives having a 5-sulfur subtituent BASF SE (DE) 2012-04-12 US disclosed
US-20120077676-A1 Antifungal 1,2,4-Triazolyl Derivatives Having a 5-Sulfur Substituent BASF SE (DE) 2012-03-29 US disclosed
WO-2010149414-A1 5-MERCAPTO-[1, 2, 4] TRIAZOLYLMETHYL-CYCLOPENTANOL COMPOUNDS AND THEIR AGRICULTURAL AND PHARMACEUTICAL USES BASF SE (DE) 2010-12-29 WO disclosed
WO-2010146111-A1 ANTIFUNGAL 1, 2, 4-TRIAZOLYL DERIVATIVES BASF SE (DE) 2010-12-23 WO disclosed
WO-2010146112-A1 ANTIFUNGAL 1, 2, 4-TRIAZOLYL DERIVATIVES BASF SE (DE) 2010-12-23 WO disclosed
WO-2010142779-A1 ANTIFUNGAL 1,2,4-TRIAZOLYL DERIVATIVES HAVING A 5- SULFUR SUBSTITUENT BASF SE (DE) 2010-12-16 WO disclosed
WO-2010122171-A1 5-HETEROARYLMETHYL-I- (B-MERCAPTO- [1,2, 4 -TRIAZOLYLMETHYL) -CYCLOPENTANOL AS FUNGICIDES BASF SE (DE) 2010-10-28 WO disclosed
WO-2010122169-A1 5-MERCAPTO- [1,2, 4] TRIAZOLE COMPOUNDS AND THEIR AGRICULTURAL AND PHARMACEUTICAL USES BASF SE (DE) 2010-10-28 WO disclosed
WO-2010122167-A1 5 -MERCAPTO- [1, 2, 4] TRIAZOLYLMETHYL-CYCLOPENTANOL COMPOUNDS AND THEIR AGRICULTURAL AND PHARMACEUTICAL USES BASF SE (DE) 2010-10-28 WO disclosed
WO-2010122170-A1 5-MERCAPTO- [1,2,4] TRIAZOLYLMETHYL-CYCLOPENTANOL COMPOUNDS AND THEIR AGRICULTURAL AND PHARMACEUTI AL USES BASF SE (DE) 2010-10-28 WO disclosed
US-5466816-A Process for preparation of azolylmethylcycloalkanol derivatives KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) 1995-11-14 US disclosed
EP-0655443-A2 Process for the preparation of azolylmethylcycloalkanol derivatives KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) 1995-05-31 EP 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 (4 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-20120088660-A1 Antifungal 1,2,4-triazolyl Derivatives ERG28, CYP51A1, DPM1 CA5A 939/4885CA5B 1209/4885KDM4E 1829/4885
US-20120088664-A1 Antifungal 1,2,4-triazolyl derivatives having a 5-sulfur subtituent STS, TST, ERG28 CA5A 616/4885CA5B 818/4885KDM4E 1818/4885
US-20120108422-A1 Antifungal 1,2,4-triazolyl Derivatives ERG28, CYP51A1, DPM1 CA5A 939/4885CA5B 1209/4885KDM4E 1829/4885
US-20120077676-A1 Antifungal 1,2,4-Triazolyl Derivatives Having a 5-Sulfur Substituent ERG28, STS, CYP51A1 CA5A 698/4885CA5B 1073/4885KDM4E 1405/4885

“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.