Sulfuric Acid

Sulfuric Acid

SCHEMBL2909992

CC[N+](CC)(CC)Cc1ccccc1.O=S(=O)(O)O

nearest known ligand 0.47

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
CYP1A2 P05177 1/20 0.46
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
LMNA P02545 2/20 0.43
CYP3A4 P08684 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
BLM P54132 1/20 0.43
GFER P55789 1/20 0.43
PMP22 Q01453 1/20 0.43
CHRNA7 P36544 2/20 0.42
CHRNB4 P30926 1/20 0.42
CHRNA3 P32297 1/20 0.42
MAPK1 P28482 2/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
CYP2D6 P10635 1/20 0.41
TSHR P16473 1/20 0.41
TAS2R10 Q9NYW0 1/20 0.41

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 SCHEMBL27570806 0.98 CYP1A2 (0.45) CYP1A2KDM4EALDH1A1TDP1LMNA
SCHEMBL330402 0.94 CYP1A2 (0.49) CYP1A2KDM4EALDH1A1TDP1LMNA
SCHEMBL331081 0.94 CYP1A2 (0.45) CYP1A2KDM4EALDH1A1TDP1LMNA
Sulfuric Acid SCHEMBL27570804 0.93 CYP1A2 (0.42) CYP1A2KDM4EALDH1A1TDP1LMNA
Sulfuric Acid SCHEMBL782175 0.92 CYP1A2 (0.44) CYP1A2KDM4EALDH1A1TDP1LMNA
Thiosulfuric Acid SCHEMBL8422607 0.92 CYP1A2 (0.44) CYP1A2KDM4EALDH1A1TDP1LMNA
Ammonia Solution, Strong SCHEMBL27995410 0.92 CYP1A2 (0.48) CYP1A2KDM4EALDH1A1TDP1LMNA
Sulfuric Acid SCHEMBL27810236 0.91 CYP1A2 (0.43) CYP1A2KDM4EALDH1A1TDP1LMNA
Sulfuric Acid SCHEMBL10541168 0.91 KDM4E (0.44) CYP1A2KDM4EALDH1A1TDP1LMNA
SCHEMBL330933 0.89 TSHR (0.55) CYP1A2KDM4EALDH1A1TDP1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021107047-A1 METHOD FOR PRODUCING 4-(AMINOMETHYL)CYCLOHEXANE CARBOXYLIC ACID 株式会社DNPファインケミカル 2021-06-03 WO disclosed
EP-1781646-B1 PROCESS FOR THE PREPARATION OF 11-(4-[2-(2-HYDROXYETHOXY)ETHYL]-1-PIPERAZINYL)DIBENZO[b,f][1,4]THIAZEPINE SK HOLDINGS CO LTD (KR) 2010-08-18 EP disclosed
US-7678902-B2 Process for the preparation of 11-(4-[2-(2-hydroxyethoxy)ethyl]-1-piperazinyl)dibenzo[b,f][1,4]thiazepine SK HOLDINGS CO., LTD. (KR) 2010-03-16 US disclosed
EP-1781646-A4 PROCESS FOR THE PREPARATION OF 11-(4-[2-(2-HYDROXYETHOXY)ETHYL]-I-PIPERAZINYL)DIBENZO[B,F][1,4]THIAZEPINE SK HOLDINGS CO LTD (KR) 2009-03-04 EP disclosed
US-20070225494-A1 Process for the Preparation of 11-(4-[2-(2-Hydroxyethoxy)Ethyl]-I-Piperazinyl)Dibenzo[b,f][I,4]Thiazepine SK CORPORATION (KR) 2007-09-27 US disclosed
EP-1781646-A1 PROCESS FOR THE PREPARATION OF 11-(4-[2-(2-HYDROXYETHOXY)ETHYL]-I-PIPERAZINYL)DIBENZO[B,F][1,4]THIAZEPINE SK Corporation (KR) 2007-05-09 EP disclosed
WO-2006001619-A1 PROCESS FOR THE PREPARATION OF 11-(4-[2-(2-HYDROXYETHOXY)ETHYL]-I-PIPERAZINYL)DIB ENZO[b,f][l,4]THIAZEPINE SK CORPORATION (KR) 2006-01-05 WO disclosed
US-4891168-A Process for producing steroid derivatives NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1990-01-02 US disclosed
EP-0261656-A1 A process for producing steroid derivatives NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1988-03-30 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 (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-20070225494-A1 Process for the Preparation of 11-(4-[2-(2-Hydroxyethoxy)Ethyl]-I-Piperazinyl)Dibenzo[b,f][I,4]Thiazepine TALDO1, QDPR, HDHD5 CYP1A2 136/4885KDM4E 775/4885ALDH1A1 299/4885

“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.