SCHEMBL5147052

SCHEMBL5147052

CCCCCCOc1ccn2nccc2n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.45
CYP2D6 P10635 3/20 0.45
SOAT1 P35610 1/20 0.38
FAAH O00519 1/20 0.38
MGLL Q99685 1/20 0.38
PDE5A O76074 2/20 0.36
PDE4A P27815 2/20 0.36
PDE4B Q07343 2/20 0.36
PDE4C Q08493 2/20 0.36
PDE4D Q08499 2/20 0.36
DYRK1A Q13627 1/20 0.36
MCHR1 Q99705 1/20 0.36
TLR8 Q9NR97 1/20 0.36
CYP1A2 P05177 2/20 0.35
CYP19A1 P11511 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
SCN5A Q14524 1/20 0.35
TGFBR1 P36897 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35

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
SCHEMBL5872614 0.74 KCNH2 (0.51) DYRK1ACYP19A1SCN5ATGFBR1
SCHEMBL8583652 0.73 SOAT1 (0.51) SOAT1FAAHMGLLMCHR1TLR8
SCHEMBL7851567 0.71 DYRK1A (0.47) DYRK1ASCN5ATGFBR1
SCHEMBL3416442 0.70 KCNH2 (0.41) CYP3A4FAAHDYRK1ATSHR
SCHEMBL24306014 0.69 SOAT1 (0.48) SOAT1FAAHMGLLMCHR1TLR8
SCHEMBL15261278 0.69 TLR8 (0.48) DYRK1ATLR8TSHR
SCHEMBL10647023 0.69 NPC1 (0.56) HRH3TSHR
SCHEMBL6195082 0.69 NPC1 (0.40) CYP3A4CYP2D6MCHR1
SCHEMBL19239931 0.69 TLR8 (0.47) CYP3A4CYP2D6SOAT1FAAHMGLL
SCHEMBL24306122 0.68 SOAT1 (0.47) SOAT1FAAHMGLLMCHR1TLR8

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