SCHEMBL3657261

SCHEMBL3657261

COC1CCN(C(=O)OCC(C)C)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.48
GAA P10253 1/20 0.42
CHRM2 P08172 1/20 0.41
CHRM1 P11229 1/20 0.41
NOS3 P29474 1/20 0.41
NOS2 P35228 1/20 0.41
GPR119 Q8TDV5 5/20 0.41
KCNQ3 O43525 2/20 0.40
KCNQ2 O43526 2/20 0.40
THRB P10828 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HSD11B1 P28845 1/20 0.39
KIT P10721 1/20 0.39
POLB P06746 1/20 0.38
TLR9 Q9NR96 1/20 0.38
TLR8 Q9NR97 1/20 0.38
TLR7 Q9NYK1 1/20 0.38
TSHR P16473 1/20 0.38
JAK2 O60674 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
SCHEMBL704010 0.84 RAB9A (0.51) RAB9AGAACHRM2CHRM1NOS3
SCHEMBL794087 0.83 RAB9A (0.50) RAB9AGAACHRM2CHRM1NOS3
SCHEMBL8262844 0.83 RAB9A (0.50) RAB9AGAACHRM2CHRM1NOS3
SCHEMBL3032184 0.82 GAA (0.61) GAACHRM1NOS3NOS2THRB
SCHEMBL5249314 0.81 GPR119 (0.45) RAB9AGAACHRM2CHRM1NOS3
SCHEMBL793658 0.81 RAB9A (0.49) RAB9AGAACHRM2CHRM1NOS3
SCHEMBL13503893 0.81 RAB9A (0.49) RAB9AGAACHRM2CHRM1NOS3
SCHEMBL4632551 0.81 RAB9A (0.49) RAB9AGAACHRM2CHRM1NOS3
SCHEMBL4633597 0.81 RAB9A (0.49) RAB9AGAACHRM2CHRM1NOS3
SCHEMBL1563419 0.81 RAB9A (0.49) RAB9AGAACHRM2CHRM1NOS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2205585-A1 QUINOLINE DERIVATIVES USED TO TREAT INFLAMMATORY AND ALLERGIC DISEASES Glaxo Group Limited (GB) 2010-07-14 EP disclosed
WO-2009050204-A1 QUINOLINE DERIVATIVES USED TO TREAT INFLAMMATORY AND ALLERGIC DISEASES GLAXO GROUP LIMITED (GB) 2009-04-23 WO disclosed