SCHEMBL7051379

SCHEMBL7051379

COCCCNCC(O)C(Cc1ccccc1)NC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BCHE P06276 5/20 0.48
BACE1 P56817 6/20 0.48
SLC6A11 P48066 1/20 0.48
KDM4E B2RXH2 3/20 0.46
LMNA P02545 2/20 0.46
MEN1 O00255 1/20 0.46
NPC1 O15118 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL3351374 1.00 BCHE (0.48) BCHEBACE1SLC6A11KDM4ELMNA
SCHEMBL3351369 1.00 BCHE (0.48) BCHEBACE1SLC6A11KDM4ELMNA
SCHEMBL3347692 0.93 BACE1 (0.50) BCHEBACE1SLC6A11
SCHEMBL3347686 0.93 BACE1 (0.50) BCHEBACE1SLC6A11
SCHEMBL3355732 0.88 ALDH1A1 (0.55) BCHEBACE1SLC6A11KDM4ETDP1
SCHEMBL3355726 0.88 ALDH1A1 (0.55) BCHEBACE1SLC6A11KDM4ETDP1
SCHEMBL6889830 0.87 ALDH1A1 (0.47) BCHEBACE1SLC6A11
SCHEMBL7606164 0.87 ALDH1A1 (0.47) BCHEBACE1SLC6A11
SCHEMBL7606169 0.87 ALDH1A1 (0.47) BCHEBACE1SLC6A11
SCHEMBL6888172 0.86 BACE1 (0.51) BCHEBACE1SLC6A11

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
JP-2004502669-A 2004-01-29 JP claimed
EP-1353898-A2 COMPOUNDS TO TREAT ALZHEIMER'S DISEASE Elan Pharmaceuticals, Inc. (US) 2003-10-22 EP claimed
WO-2002002512-A2 COMPOUNDS TO TREAT ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2002-01-10 WO claimed