Sulfuric Acid

Sulfuric Acid

SCHEMBL8435875

CC(O)N(O)c1ccccc1.O=S(=O)(O)O

nearest known ligand 0.44

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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 4/20 0.44
LMNA P02545 3/20 0.44
KDM4E B2RXH2 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
KMT2A Q03164 2/20 0.44
GMNN O75496 1/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
PMP22 Q01453 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ESR1 P03372 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
TP53 P04637 1/20 0.41
HSP90AA1 P07900 1/20 0.39
ALOX5 P09917 1/20 0.39
TSHR P16473 3/20 0.37
CA12 O43570 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35

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
SCHEMBL9354511 0.89 ALOX5 (0.41) ALDH1A1LMNAKDM4ENPSR1KMT2A
Sulfuric Acid SCHEMBL6528425 0.78 ALDH1A1 (0.43) ALDH1A1LMNAKDM4ENPSR1KMT2A
SCHEMBL6399613 0.78 ALDH1A1 (0.44) ALDH1A1LMNAKDM4ENPSR1KMT2A
SCHEMBL11526750 0.76 ESR1 (0.50) ALDH1A1LMNAKDM4ENPSR1KMT2A
Sulfuric Acid SCHEMBL9329973 0.76 TP53 (0.46) ALDH1A1LMNAKDM4ENPSR1KMT2A
SCHEMBL19520807 0.74 ALDH1A1 (0.37) ALDH1A1LMNAKDM4ENPSR1POLB
SCHEMBL10794573 0.73 ESR1 (0.40) ALDH1A1LMNAKDM4ENPSR1KMT2A
Sulfuric Acid SCHEMBL4958447 0.72 HPGD (0.54) ALDH1A1KDM4EKMT2AMAPTHPGD
SCHEMBL4387215 0.71 ALDH1A1 (0.43) ALDH1A1LMNANPSR1KMT2AESR1
SCHEMBL4387218 0.71 ALDH1A1 (0.43) ALDH1A1LMNANPSR1KMT2AESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5962391-A CLEANING COMPOUND; REMOVAL GREASES AND TARS COLGATE-PALMOLIVE CO. (US) 1999-10-05 US disclosed
EP-0873394-A1 NEAR TRICRITICAL POINT COMPOSITIONS Colgate-Palmolive Company (US) 1998-10-28 EP disclosed
EP-0873392-A1 GELLED NEAR TRICRITICAL POINT COMPOSITIONS Colgate-Palmolive Company (US) 1998-10-28 EP disclosed
US-5750487-A MISCIBLE LIQUID PHASE MIXTURE OF POLAR SOLVENT, AMPHIPATHIC COMPOUND, AND NONPOLAR SOLVENT; SURFACTANT-FREE CLEANING COMPOUNDS COLGATE-PALMOLIVE CO. (US) 1998-05-12 US disclosed
WO-1998001527-A1 NEAR TRICRITICAL POINT COMPOSITIONS CONTAINING BLEACH AND/OR BIOSTATIC AGENT COLGATE-PALMOLIVE COMPANY (US) 1998-01-15 WO disclosed
US-5665268-A CLEANING COMPOSITION FOR REMOVAL OF GREASE OR TAR COLGATE-PALMOLIVE COMPANY 1997-09-09 US disclosed
US-5643861-A Near tricritical point compositions containing a bleach and/or a disinfecting agent COLGATE-PALMOLIVE CO. (US) 1997-07-01 US disclosed
WO-1997019164-A1 NEAR TRICRITICAL POINT COMPOSITIONS COLGATE-PALMOLIVE COMPANY (US) 1997-05-29 WO disclosed
WO-1997015653-A1 GELLED NEAR TRICRITICAL POINT COMPOSITIONS COLGATE-PALMOLIVE COMPANY (US) 1997-05-01 WO disclosed
US-5585034-A AQUEOUS CLEANING MIXTURES CONTAINING LOW MOLECULAR WEIGHT POLYACRYLIC ACIDS OR POLYACRYLAMIDES, POLAR SOLVENTS, WATER SOLUBLE AMPHIPHILES AND NON-POLAR SOLVENTS COLGATE-PALMOLIVE CO. (US) 1996-12-17 US disclosed
US-5527486-A LIQUID CLEANING COMPOSITION COLGATE-PALMOLIVE CO. (US) 1996-06-18 US disclosed
US-5527485-A THREE PHASES INCORPORATE A POLAR SOLVENT, A NON-POLAR SOLVENT AND A WATER SOLUBLE OR LOW MOLECULAR WEIGHT WATER DISPERSIBLE AMPHIPHILE COLGATE-PALMOLIVE CO. (US) 1996-06-18 US disclosed