Sulfuric Acid

Sulfuric Acid

SCHEMBL986841

CC(=O)NC1CC(C)(C)N(C)C(C)(C)C1.O=S(=O)(O)O

nearest known ligand 0.39

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
HDAC4 P56524 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
CA1 P00915 5/20 0.36
CA2 P00918 5/20 0.36
CA12 O43570 2/20 0.36
CA7 P43166 2/20 0.36
CA14 Q9ULX7 2/20 0.36
ATM Q13315 2/20 0.34
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 3/20 0.34
GAA P10253 2/20 0.34
CA9 Q16790 3/20 0.33
KMT2A Q03164 1/20 0.32
ALOX15 P16050 1/20 0.32
METAP2 P50579 1/20 0.32
FLT3 P36888 1/20 0.31
TYRO3 Q06418 1/20 0.31
MERTK Q12866 1/20 0.31
GAS6 Q14393 1/20 0.31
EPHX1 P07099 1/20 0.30

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
SCHEMBL8613134 0.93 HDAC4 (0.39) HDAC4HDAC6CA1CA2CA12
Sulfuric Acid SCHEMBL16155934 0.86 KDM4E (0.47) CA1CA2CA12CA7CA14
Sulfuric Acid SCHEMBL987819 0.86 KDM4E (0.47) CA1CA2CA12CA7CA14
SCHEMBL9456416 0.79 EPHX2 (0.40) HDAC4HDAC6ALDH1A1KDM4EGAA
SCHEMBL319902 0.77 MAOB (0.43) CA1CA2CA12ATMALDH1A1
SCHEMBL272472 0.77 GAA (0.51) CA1CA2CA12ATMALDH1A1
SCHEMBL28889135 0.77 HDAC4 (0.39) HDAC4HDAC6KDM4EGAAKMT2A
Edetic Acid SCHEMBL986797 0.77 TDP1 (0.40) HDAC4HDAC6ALDH1A1KDM4EALOX15
Sulfuric Acid SCHEMBL986271 0.76 RECQL (0.49) ATMALDH1A1KDM4EGAAKMT2A
Pentetic Acid SCHEMBL986427 0.76 TDP1 (0.42) HDAC4HDAC6ALDH1A1KDM4EALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7862746-B2 Stabilization of natural composites BASF SE. (DE) 2011-01-04 US claimed
WO-2006087269-A1 STABILIZATION OF NATURAL COMPOSITES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2006-08-24 WO claimed
US-20060183821-A1 Stabilization of natural composites CIBA CORPORATION 2006-08-17 US claimed
US-7862746-B2 Stabilization of natural composites BASF SE. (DE) 2011-01-04 US disclosed
US-20060183821-A1 Stabilization of natural composites CIBA CORPORATION 2006-08-17 US disclosed