SCHEMBL8346963

SCHEMBL8346963

C[N+]1(Cc2ccccc2)CCC(=O)CC1.O=[N+]([O-])[O-]

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 5/20 0.43
CHRM3 P20309 4/20 0.40
ACHE P22303 9/20 0.38
CHRM2 P08172 2/20 0.36
CHRNB2 P17787 1/20 0.35
CHRNA4 P43681 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
SCHEMBL321885 0.92 CHRNA7 (0.48) CHRNA7CHRM3ACHECHRM2CHRNB2
Bromide SCHEMBL1140066 0.90 CHRNA7 (0.50) CHRNA7CHRM3ACHECHRM2CHRNB2
Iodide SCHEMBL195619 0.90 CHRNA7 (0.47) CHRNA7CHRM3ACHECHRM2CHRNB2
SCHEMBL4258543 0.86 CHRNA7 (0.42) CHRNA7CHRM3ACHECHRM2CHRNB2
SCHEMBL4256635 0.82 CHRNA7 (0.45) CHRNA7CHRM3ACHECHRM2
SCHEMBL10256548 0.81 CHRNA7 (0.52) CHRNA7CHRM3ACHECHRM2CHRNB2
Trifluoromethanesulfonic Acid SCHEMBL8349313 0.81 CHRNA7 (0.39) CHRNA7CHRM3ACHECHRM2
Hydrochloric Acid SCHEMBL11194479 0.81 CHRNA7 (0.47) CHRNA7CHRM3ACHECHRNB2CHRNA4
Bromide SCHEMBL17543511 0.76 ALDH1A1 (0.45) ACHE
SCHEMBL8352193 0.75

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999023197-A1 PROCESSES OF SOAKING FABRICS WITH A LIQUID AQUEOUS PERSULFATE SALT-CONTAINING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1999-05-14 WO claimed
WO-1999023196-A1 LIQUID AQUEOUS BLEACHING COMPOSITIONS PACKAGED IN A UV RESISTANT CONTAINER THE PROCTER & GAMBLE COMPANY (US) 1999-05-14 WO claimed
WO-1999023294-A1 PROCESSES OF BLEACHING FABRICS THE PROCTER & GAMBLE COMPANY (US) 1999-05-14 WO claimed
WO-1999023195-A1 MULTI-PURPOSE LIQUID AQUEOUS BLEACHING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1999-05-14 WO claimed
EP-0915150-A1 Processes of soaking fabrics with a liquid aqueous persulfate salt-containing composition THE PROCTER & GAMBLE COMPANY (US) 1999-05-12 EP claimed
EP-0913463-A1 Multi-purpose liquid aqueous bleaching compositions THE PROCTER & GAMBLE COMPANY (US) 1999-05-06 EP claimed
EP-0913515-A1 Process of bleaching fabrics THE PROCTER & GAMBLE COMPANY (US) 1999-05-06 EP claimed
EP-0913462-A1 Liquid aqueous bleaching compositions packaged in a UV-resistant container THE PROCTER & GAMBLE COMPANY (US) 1999-05-06 EP claimed
US-6007735-A Coated bleach tablet and method ECOLAB INC. (US) 1999-12-28 US disclosed
WO-1999023196-A1 LIQUID AQUEOUS BLEACHING COMPOSITIONS PACKAGED IN A UV RESISTANT CONTAINER THE PROCTER & GAMBLE COMPANY (US) 1999-05-14 WO disclosed
WO-1999023294-A1 PROCESSES OF BLEACHING FABRICS THE PROCTER & GAMBLE COMPANY (US) 1999-05-14 WO disclosed
WO-1999023197-A1 PROCESSES OF SOAKING FABRICS WITH A LIQUID AQUEOUS PERSULFATE SALT-CONTAINING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1999-05-14 WO disclosed
WO-1999023195-A1 MULTI-PURPOSE LIQUID AQUEOUS BLEACHING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1999-05-14 WO disclosed
EP-0915150-A1 Processes of soaking fabrics with a liquid aqueous persulfate salt-containing composition THE PROCTER & GAMBLE COMPANY (US) 1999-05-12 EP disclosed
EP-0913463-A1 Multi-purpose liquid aqueous bleaching compositions THE PROCTER & GAMBLE COMPANY (US) 1999-05-06 EP disclosed
EP-0913515-A1 Process of bleaching fabrics THE PROCTER & GAMBLE COMPANY (US) 1999-05-06 EP disclosed
EP-0875558-A2 Coated bleach tablet and dispensing method ECOLAB INC. (US) 1998-11-04 EP disclosed
US-4421664-A REDUCING AGENT TO DELAY DEACTIVATION OF ENZYME ECONOMICS LABORATORY, INC. (US) 1983-12-20 US disclosed
US-4011169-A USING AN ENZYME AND AMINATED POLYSACCHARIDE THE PROCTER & GAMBLE COMPANY (US) 1977-03-08 US disclosed
US-3944470-A AMINATED POLYSACCHARIDE THE PROCTER & GAMBLE COMPANY (US) 1976-03-16 US disclosed