Sulfuric Acid

Sulfuric Acid

SCHEMBL7754307

CN1CCCC1C(N)=O.O=S(=O)(O)O

nearest known ligand 0.42

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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 12)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
BCHE P06276 1/20 0.34
DPP4 P27487 4/20 0.34
L3MBTL3 Q96JM7 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
AR P10275 1/20 0.32
CA2 P00918 1/20 0.32
POLB P06746 1/20 0.32
PIK3CD O00329 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CG P48736 1/20 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
SCHEMBL4404382 0.92
SCHEMBL153362 0.92
SCHEMBL1369765 0.92
Hydrochloric Acid SCHEMBL28784700 0.90 CYP3A4 (0.42) CYP3A4CYP2D6BCHEDPP4L3MBTL3
Hydrochloric Acid SCHEMBL530195 0.90 CYP3A4 (0.42) CYP3A4CYP2D6BCHEDPP4L3MBTL3
Hydrochloric Acid SCHEMBL3965022 0.90 CYP3A4 (0.42) CYP3A4CYP2D6BCHEDPP4L3MBTL3
SCHEMBL9921624 0.86 CYP3A4 (0.39) CYP3A4CYP2D6BCHESMN1; SMN2CA2
SCHEMBL11920765 0.86 CYP3A4 (0.39) CYP3A4CYP2D6BCHESMN1; SMN2CA2
SCHEMBL2557179 0.86 CYP3A4 (0.39) CYP3A4CYP2D6BCHESMN1; SMN2CA2
SCHEMBL23279249 0.84 CYP3A4 (0.38) CYP3A4CYP2D6SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0775228-B1 PREVENTION OF PHOTOBLEACHING OF WOOL AND/OR OTHER NATURAL FIBRES WOOL RES ORG NEW ZEALAND INC (NZ) 2001-02-21 EP disclosed
EP-0775228-A4 A METHOD OF PREVENTING PHOTOBLEACHING OF WOOL AND/OR OTHER NATURAL FIBRES WOOL RES ORGANISATION (NZ) 1998-05-27 EP disclosed
EP-0775228-A1 A METHOD OF PREVENTING PHOTOBLEACHING OF WOOL AND/OR OTHER NATURAL FIBRES WOOL RESEARCH ORGANISATION OF NEW ZEALAND INCORPORATED (NZ) 1997-05-28 EP disclosed
WO-1996005357-A1 A METHOD OF PREVENTING PHOTOBLEACHING OF WOOL AND/OR OTHER NATURAL FIBRES WOOL RESEARCH ORGANISATION OF NEW ZEALAND (INC) (NZ) 1996-02-22 WO disclosed