Sulfuric Acid

Sulfuric Acid

SCHEMBL986271

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

nearest known ligand 0.49

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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 14)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.49
POLB P06746 2/20 0.47
GAA P10253 1/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
ALDH1A1 P00352 1/20 0.44
EZH2 Q15910 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
ATM Q13315 1/20 0.43
HSD17B10 Q99714 1/20 0.43
HTT P42858 1/20 0.43
GLA P06280 1/20 0.43
KDM4E B2RXH2 1/20 0.42
PKM P14618 1/20 0.42

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
SCHEMBL77511 0.92 RECQL (0.55) RECQLPOLBGAAKMT2AMEN1
SCHEMBL29453034 0.90 RECQL (0.53) RECQLPOLBGAAKMT2AMEN1
SCHEMBL6109968 0.82 RECQL (0.46) RECQLPOLBGAAKMT2AALDH1A1
Nitrilotriacetic Acid SCHEMBL986939 0.78 GAA (0.48) RECQLPOLBGAAKMT2AALDH1A1
SCHEMBL10525290 0.78 RECQL (0.57) RECQLPOLBGAAKMT2AMEN1
SCHEMBL3295977 0.78 RECQL (0.57) RECQLPOLBGAAKMT2AMEN1
Sulfuric Acid SCHEMBL987819 0.76 KDM4E (0.47) GAAKMT2AALDH1A1L3MBTL1ATM
Sulfuric Acid SCHEMBL16155934 0.76 KDM4E (0.47) GAAKMT2AALDH1A1L3MBTL1ATM
Sulfuric Acid SCHEMBL986841 0.76 HDAC4 (0.36) GAAKMT2AALDH1A1ATMKDM4E
SCHEMBL28402532 0.76 POLB (0.57) RECQLPOLBGAAKMT2AMEN1

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 6 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
WO-2006087269-A1 STABILIZATION OF NATURAL COMPOSITES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2006-08-24 WO disclosed
US-20060183821-A1 Stabilization of natural composites CIBA CORPORATION 2006-08-17 US disclosed