SCHEMBL8322904

SCHEMBL8322904

NCCCCCC(=O)N1CCC(CCC=O)CC1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 9/20 0.50
GNAI1 P63096 9/20 0.50
GNAO1 P09471 8/20 0.50
ITGB3 P05106 4/20 0.47
ITGA2B P08514 4/20 0.47
NPC1 O15118 1/20 0.41
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
SMYD3 Q9H7B4 1/20 0.38

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
SCHEMBL22223262 0.84 GNAI3 (0.54) GNAI3GNAI1GNAO1ITGB3ITGA2B
SCHEMBL26038975 0.81 GNAI3 (0.66) GNAI3GNAI1GNAO1ITGB3ITGA2B
SCHEMBL26038984 0.80 GNAI3 (0.68) GNAI3GNAI1GNAO1ITGB3ITGA2B
SCHEMBL25499339 0.78 GNAI3 (0.51) GNAI3GNAI1GNAO1ITGB3ITGA2B
SCHEMBL25500677 0.77 GNAI3 (0.50) GNAI3GNAI1GNAO1ITGB3ITGA2B
SCHEMBL25499340 0.77 GNAI3 (0.50) GNAI3GNAI1GNAO1ITGB3ITGA2B
SCHEMBL26038977 0.77 GNAI3 (0.50) GNAI3GNAI1GNAO1ITGB3ITGA2B
SCHEMBL17739583 0.75 GNAI3 (0.51) GNAI3GNAI1GNAO1ITGB3ITGA2B
Ammonia Solution, Strong SCHEMBL3990591 0.74 GNAI3 (0.55) GNAI3GNAI1GNAO1ITGB3ITGA2B
SCHEMBL5242757 0.74 ITGB3 (0.54) GNAI3GNAI1GNAO1ITGB3ITGA2B

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
WO-2004058686-A1 HYDROXYPROPYL AMIDES FOR THE TREATMENT OF ALZHEIMER’S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2004-07-15 WO disclosed