Sulfuric Acid

Sulfuric Acid

SCHEMBL6207762

Cc1cc2c(cc1O)N(c1ccccc1)c1cc(O)c(C)cc1N2.O=S(=O)(O)O

nearest known ligand 0.42

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
CHRM1 known ✓ P11229 1/20 0.32
KDM4E B2RXH2 5/20 0.42
GNG2 P59768 1/20 0.38
GNB1 P62873 1/20 0.38
ALDH1A1 P00352 4/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 2/20 0.33
POLB P06746 1/20 0.33
APEX1 P27695 1/20 0.33
ACHE P22303 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
MPL P40238 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
XBP1 P17861 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
S1PR1 P21453 1/20 0.32
S1PR3 Q99500 1/20 0.32
ESR1 P03372 2/20 0.32

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
SCHEMBL6208676 0.93 KDM4E (0.43) KDM4EGNG2GNB1ALDH1A1HSD17B10
SCHEMBL114129 0.74 KDM4E (0.43) KDM4EGNG2GNB1ALDH1A1HSD17B10
Hydrochloric Acid SCHEMBL30431952 0.73 KDM4E (0.42) KDM4EGNG2GNB1ALDH1A1HSD17B10
Sulfuric Acid SCHEMBL4925404 0.71 GNG2 (0.55) KDM4EGNG2GNB1ALDH1A1HSD17B10
Sulfuric Acid SCHEMBL944027 0.70 GNG2 (0.40) KDM4EGNG2GNB1ALDH1A1TDP1
Sulfuric Acid SCHEMBL2987166 0.69 ALDH1A1 (0.43) KDM4EGNG2GNB1ALDH1A1HSD17B10
SCHEMBL29638503 0.68 ALDH1A1 (0.53) KDM4EGNG2GNB1ALDH1A1HSD17B10
Sulfuric Acid SCHEMBL31536708 0.68 GNG2 (0.38) KDM4EGNG2GNB1ALDH1A1TDP1
SCHEMBL5134183 0.68 ALDH1A1 (0.43) KDM4EGNG2GNB1ALDH1A1HSD17B10
SCHEMBL863274 0.68 ALDH1A1 (0.43) KDM4EGNG2GNB1ALDH1A1HSD17B10

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
EP-1292268-B1 AGENT FOR DYEING KERATIN CONTAINING FIBERS HENKEL KGAA (DE) 2005-02-23 EP claimed