SCHEMBL5046282

SCHEMBL5046282

O=C(O)CN1CCC(CCCCc2ccncc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.44
ACHE P22303 2/20 0.43
ITGB3 P05106 2/20 0.42
ITGA2B P08514 2/20 0.42
GSK3B P49841 1/20 0.42
SIGMAR1 Q99720 2/20 0.41
CCR3 P51677 1/20 0.41
DRD4 P21917 1/20 0.40
SLC6A4 P31645 1/20 0.40
MAPK11 Q15759 1/20 0.40
MAPK14 Q16539 1/20 0.40
FAAH O00519 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
SLC18A3 Q16572 1/20 0.40

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
SCHEMBL3867303 0.84 KDM4E (0.44) ACHEFAAHSLC18A3
SCHEMBL388228 0.83 NAMPT (0.40) ACHEGSK3BFAAHHRH3
SCHEMBL389762 0.83 NPY1R (0.44) ACHEGSK3BHRH3
Pivalamide SCHEMBL27687991 0.77 NAMPT (0.43) ACHEFAAHSLC18A3
SCHEMBL7790339 0.77 ITGB3 (0.55) ITGB3ITGA2B
Hydrochloric Acid SCHEMBL27840803 0.76 MAOA (0.58) ACHE
SCHEMBL13989442 0.76 MEN1 (0.54) FAAH
SCHEMBL27707196 0.76 NAMPT (0.42) ACHEFAAHHRH3
SCHEMBL389808 0.76 CYP2C9 (0.54) FAAH
SCHEMBL7788442 0.76 ITGB3 (0.55) ITGB3ITGA2B

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-2004157-A2 USE OF GPR119 RECEPTOR AGONISTS FOR INCREASING BONE MASS AND FOR TREATING OSTEOPOROSIS, AS WELL AS COMBINATION THERAPY RELATING THERETO Arena Pharmaceuticals, Inc. (US) 2008-12-24 EP disclosed
WO-2007120702-A2 USE OF GPR119 RECEPTOR AGONISTS FOR INCREASING BONE MASS AND FOR TREATING OSTEOPOROSIS, AND COMBINATION THERAPY RELATING THERETO ARENA PHARMACEUTICALS, INC. (US) 2007-10-25 WO disclosed