SCHEMBL13624405

SCHEMBL13624405

CCN1CCC(CC(=O)O)CC1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
FFAR4 Q5NUL3 3/20 0.35
ACE P12821 2/20 0.35
ITGB3 P05106 1/20 0.34
ITGB2 P05107 1/20 0.34
ITGB1 P05556 1/20 0.34
ITGAV P06756 1/20 0.34
ITGA2B P08514 1/20 0.34
ITGA5 P08648 1/20 0.34
ITGB5 P18084 1/20 0.34
ITGAL P20701 1/20 0.34
BRD4 O60885 1/20 0.34
TSHR P16473 1/20 0.34
AKR1C4 P17516 1/20 0.34
AKR1C3 P42330 1/20 0.34
AKR1C2 P52895 1/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL3491063 0.84 L3MBTL1 (0.43) POLBALDH1A1MAPTTDP1FFAR4
SCHEMBL17294311 0.83 BRD4 (0.42) POLBALDH1A1MAPTTDP1ITGB3
SCHEMBL13624406 0.83 GAA (0.38) ALDH1A1BRD4GAAL3MBTL1
SCHEMBL13624403 0.81 POLB (0.40) POLBALDH1A1MAPTBRD4
SCHEMBL13624400 0.78 PIK3CD (0.32) BRD4
SCHEMBL14636509 0.76 POLB (0.50) POLBALDH1A1MAPTGAAL3MBTL1
SCHEMBL21106863 0.75 PIK3CD (0.39) POLBALDH1A1MAPTBRD4
SCHEMBL21484158 0.75 PRKCB (0.34) ALDH1A1L3MBTL1
SCHEMBL1272035 0.73 HSD17B10 (0.33)
SCHEMBL21945155 0.72 USP19 (0.36) BRD4

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-7612075-B2 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2009-11-03 US disclosed