SCHEMBL14218446

SCHEMBL14218446

CN(C)CCCCOC(=O)c1ccc(/C=C/c2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BCHE P06276 10/20 0.60
ACHE P22303 10/20 0.60
GAA P10253 1/20 0.58
TDP1 Q9NUW8 1/20 0.55
ALDH1A1 P00352 3/20 0.54
PHLPP2 Q6ZVD8 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.46

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
SCHEMBL8055450 0.87 TDP1 (0.73) BCHEACHEGAATDP1ALDH1A1
SCHEMBL27579412 0.86 TDP1 (0.71) BCHEACHEGAATDP1ALDH1A1
SCHEMBL14218219 0.85 GAA (0.62) BCHEACHEGAATDP1ALDH1A1
SCHEMBL11287086 0.82 GAA (0.71) ACHEGAATDP1ALDH1A1PHLPP2
SCHEMBL29030409 0.81 TDP1 (0.59) TDP1ALDH1A1SMN1; SMN2LMNA
SCHEMBL9629064 0.81 GAA (0.84) ACHEGAATDP1ALDH1A1PHLPP2
SCHEMBL7921543 0.81 LMNA (0.66) BCHEACHEALDH1A1SMN1; SMN2LMNA
SCHEMBL7921547 0.81 LMNA (0.66) BCHEACHEALDH1A1SMN1; SMN2LMNA
SCHEMBL11358749 0.80 GAA (0.68) ACHEGAATDP1ALDH1A1PHLPP2
SCHEMBL7915244 0.80 LMNA (0.64) BCHEACHEALDH1A1SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1641729-B1 USE OF FUNCTIONALIZED ONIUM SALTS AS A SOLUBLE SUPPORT FOR ORGANIC SYNTHESIS CENTRE NAT RECH SCIENT (FR) 2008-05-07 EP disclosed