Sulfuric Acid

Sulfuric Acid

SCHEMBL6092879

CCN(CC)c1ccc(Cc2ccc(N(CC)CC)cc2)cc1.O=S(=O)(O)O

nearest known ligand 0.58

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 5/20 0.58
L3MBTL1 Q9Y468 3/20 0.58
MEN1 O00255 2/20 0.58
HPGD P15428 2/20 0.58
KMT2A Q03164 2/20 0.58
HSP90AA1 P07900 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
ALDH3A1 P30838 1/20 0.53
ALDH1A3 P47895 1/20 0.53
CNR2 P34972 12/20 0.49
MAPT P10636 2/20 0.49
CNR1 P21554 4/20 0.47
CYP3A4 P08684 2/20 0.47
TSHR P16473 2/20 0.47
MAPK1 P28482 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
PSMD14 O00487 1/20 0.47
RECQL P46063 1/20 0.47
GFER P55789 1/20 0.47

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 SCHEMBL7589189 0.93 CNR2 (0.59) ALDH1A1L3MBTL1MEN1HPGDKMT2A
SCHEMBL1655689 0.87 ALDH1A1 (0.60) ALDH1A1L3MBTL1MEN1KMT2AALDH3A1
SCHEMBL11036559 0.83 ALDH1A1 (0.45) ALDH1A1L3MBTL1MEN1HPGDKMT2A
Sulfuric Acid SCHEMBL11688477 0.82 ALDH1A1 (0.59) ALDH1A1L3MBTL1MEN1HPGDKMT2A
SCHEMBL77957 0.81 ALDH1A1 (0.54) ALDH1A1L3MBTL1MEN1KMT2AALDH3A1
Sulfuric Acid SCHEMBL1304807 0.80 ALDH1A1 (0.76) ALDH1A1L3MBTL1MEN1HPGDKMT2A
Diethylaniline SCHEMBL9487131 0.79 ALDH1A1 (0.56) ALDH1A1L3MBTL1MEN1HPGDKMT2A
SCHEMBL3686969 0.79 CNR2 (0.71) ALDH1A1L3MBTL1MEN1KMT2ACYP2C9
SCHEMBL15488866 0.79 CNR2 (0.56) ALDH1A1L3MBTL1CYP2C19ALDH3A1ALDH1A3
SCHEMBL8601618 0.79 CNR2 (0.46) ALDH1A1L3MBTL1MEN1HPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060183781-A1 Novel thiazolylmethyl pyrazoles, method for the production thereof, and use thereof in dyes for keratin fibers WELLA AG (DE) 2006-08-17 US 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-20060183781-A1 Novel thiazolylmethyl pyrazoles, method for the production thereof, and use thereof in dyes for keratin fibers KRT18, CBR3, CDC73 ALDH1A1 118/4885L3MBTL1 3731/4885MEN1 4522/4885

“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.