SCHEMBL14307656

SCHEMBL14307656

COC(=O)C(N)CCCCN(C)Cc1ccccc1B(O)O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 3/20 0.42
BCHE P06276 3/20 0.42
ACHE P22303 3/20 0.42
CHRM1 P11229 1/20 0.42
LTA4H P09960 1/20 0.41
APP P05067 3/20 0.40
MAOB P27338 2/20 0.37
DPP8 Q6V1X1 1/20 0.36
DPP9 Q86TI2 1/20 0.36
DPP7 Q9UHL4 1/20 0.36

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
SCHEMBL14318665 0.91 LTA4H (0.43) CHRM2BCHEACHECHRM1LTA4H
SCHEMBL14318657 0.80 DPP7 (0.43) CHRM2BCHEACHECHRM1DPP8
SCHEMBL14307661 0.78 DPP7 (0.44) CHRM2BCHEACHECHRM1DPP7
SCHEMBL29953487 0.75 CHRM2 (0.48) CHRM2BCHEACHECHRM1APP
SCHEMBL2118773 0.75 LIPG (0.44) CHRM2BCHEACHECHRM1
SCHEMBL14282727 0.73 F2 (0.40)
SCHEMBL2119569 0.72 CARM1 (0.53) CHRM2
SCHEMBL4602597 0.71 LTA4H (0.39) CHRM2CHRM1LTA4H
SCHEMBL4602594 0.71 LTA4H (0.39) CHRM2CHRM1LTA4H
SCHEMBL14753645 0.71 LIPG (0.47) CHRM2BCHEACHECHRM1

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
US-7316999-B2 Glucose dependent release of insulin from glucose sensing insulin derivatives NOVO NORDISK A/S (DK) 2008-01-08 US disclosed