SCHEMBL4790280

SCHEMBL4790280

CC(C)N1CCC(=O)CC1.CC(C)N1CCCC(=O)C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.38
ALDH1A1 P00352 3/20 0.38
GAA P10253 2/20 0.38
THRB P10828 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TRIM24 O15164 2/20 0.33
TRIM33 Q9UPN9 2/20 0.33
PIK3CD O00329 1/20 0.32
GRIA1 P42261 1/20 0.31
GRIA2 P42262 1/20 0.31
GRIA3 P42263 1/20 0.31
GRIA4 P48058 1/20 0.31
HRH3 Q9Y5N1 4/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
BRD4 O60885 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
SCHEMBL1698543 0.92 ALDH1A1 (0.39) CHRNA7ALDH1A1GAATHRBL3MBTL1
SCHEMBL12205477 0.92 CHRNA7 (0.43) CHRNA7ALDH1A1GAATHRBL3MBTL1
Hydrochloric Acid SCHEMBL3741338 0.90 ALDH1A1 (0.38) CHRNA7ALDH1A1GAATHRBL3MBTL1
Bromide SCHEMBL3734670 0.90 ALDH1A1 (0.38) CHRNA7ALDH1A1GAATHRBL3MBTL1
SCHEMBL11670185 0.88
SCHEMBL11776413 0.86 ALDH1A1 (0.38) CHRNA7ALDH1A1GAATHRBL3MBTL1
SCHEMBL190568 0.83 CHRNA7 (0.50) CHRNA7ALDH1A1GAATHRBL3MBTL1
Hydrochloric Acid SCHEMBL3732680 0.81 CHRNA7 (0.48) CHRNA7ALDH1A1GAATHRBL3MBTL1
Iodide SCHEMBL6583609 0.81 CHRNA7 (0.48) CHRNA7ALDH1A1GAATHRBL3MBTL1
Bromide SCHEMBL3731956 0.81 CHRNA7 (0.48) CHRNA7ALDH1A1GAATHRBL3MBTL1

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-2007343-A1 BLEACHING AGENTS CONTAINING PIPERIDONES Henkel AG & Co. KGaA (DE) 2008-12-31 EP disclosed
WO-2008022996-A1 LIGHTENING AGENTS AND/OR COLORANTS CONTAINING POLYOL ESTERS HENKEL AG & CO. KGAA (DE) 2008-02-28 WO disclosed
WO-2007118618-A1 BLEACHING AGENTS CONTAINING PIPERIDONES HENKEL AG & CO. KGAA (DE) 2007-10-25 WO disclosed