Sulfuric Acid

Sulfuric Acid

SCHEMBL9488804

CCC(CNc1ccc(N)c(C)c1)NS(C)(=O)=O.O=S(=O)(O)O

nearest known ligand 0.38

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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
RECQL P46063 2/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP3A4 P08684 1/20 0.38
THRB P10828 1/20 0.38
ALOX15 P16050 1/20 0.38
HIF1A Q16665 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
NR3C1 P04150 9/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
PGR P06401 8/20 0.32
NR3C2 P08235 8/20 0.32
HPGD P15428 1/20 0.32
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
CA7 P43166 2/20 0.31
CA14 Q9ULX7 1/20 0.31
ESR1 P03372 1/20 0.31
AR P10275 1/20 0.31
ESR2 Q92731 1/20 0.31
CA12 O43570 1/20 0.31

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
SCHEMBL8351079 0.96 ALDH1A1 (0.37) RECQLALDH1A1CYP3A4THRBALOX15
SCHEMBL5888492 0.78 ALDH1A1 (0.41) RECQLALDH1A1CYP3A4THRBALOX15
Sulfuric Acid SCHEMBL7749074 0.78 ALDH1A1 (0.47) RECQLALDH1A1CYP3A4THRBALOX15
Sulfuric Acid SCHEMBL8216715 0.78 ALDH1A1 (0.42) RECQLALDH1A1CYP3A4THRBALOX15
Methanesulfonamide SCHEMBL9569316 0.77 ALDH1A1 (0.44) RECQLALDH1A1CYP3A4THRBALOX15
Sulfuric Acid SCHEMBL11044859 0.77 ALDH1A1 (0.46) RECQLALDH1A1CYP3A4THRBALOX15
Sulfuric Acid SCHEMBL9799185 0.76 ALDH1A1 (0.41) RECQLALDH1A1CYP3A4THRBALOX15
SCHEMBL6018559 0.76 ALDH1A1 (0.43) RECQLALDH1A1CYP3A4THRBALOX15
SCHEMBL8024990 0.75 ALDH1A1 (0.37) RECQLALDH1A1CYP3A4THRBALOX15
Sulfuric Acid SCHEMBL10429917 0.75 ALDH1A1 (0.42) RECQLALDH1A1CYP3A4THRBALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0280505-B1 SILVER HALIDE COLOR PHOTOGRAPHIC LIGHT-SENSITIVE MATERIAL KONICA CORPORATION (JP) 1993-01-27 EP disclosed
US-4865961-A CYAN COUPLER KONICA CORPORATION (JP) 1989-09-12 US disclosed
EP-0280505-A2 Silver halide color photographic light-sensitive material KONICA CORPORATION (JP) 1988-08-31 EP disclosed