SCHEMBL27769045

SCHEMBL27769045

CCOC(=O)C(c1ccncc1)C1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 3/20 0.49
GPR119 Q8TDV5 11/20 0.49
IDO1 P14902 3/20 0.46
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
DPP4 P27487 1/20 0.45
KEAP1 Q14145 1/20 0.45
NFE2L2 Q16236 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
SCHEMBL17892096 0.86 ALDH1A1 (0.48) MMP13GPR119NPC1ALDH1A1MAPT
SCHEMBL34461284 0.84 MMP13 (0.54) MMP13GPR119IDO1NPC1ALDH1A1
SCHEMBL4242463 0.83 GPR119 (0.53) MMP13GPR119IDO1NPC1ALDH1A1
SCHEMBL6148439 0.82 MMP13 (0.54) MMP13GPR119IDO1NPC1ALDH1A1
SCHEMBL31066309 0.81 GPR119 (0.53) GPR119ALDH1A1
SCHEMBL27769007 0.81 MMP13 (0.53) MMP13GPR119IDO1NPC1ALDH1A1
SCHEMBL27747865 0.79 MMP13 (0.49) MMP13GPR119IDO1NPC1ALDH1A1
SCHEMBL387604 0.78 MMP13 (0.48) MMP13GPR119IDO1NPC1ALDH1A1
SCHEMBL27769137 0.78 MMP13 (0.51) MMP13GPR119IDO1DPP4
SCHEMBL5649711 0.78 ALDH1A1 (0.55) MMP13GPR119NPC1ALDH1A1MAPT

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
CN-101420941-A Use of GPR119 receptor agonists for increasing bone mass and for treating osteoporosis, and related combination therapies ARENA PHARM INC (US) 2009-04-29 CN disclosed