SCHEMBL388447

SCHEMBL388447

N#Cc1nccc2oc(-c3nc(CC4CCN(C(=O)OC5CCOC5)CC4)no3)cc12

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 10/20 0.38
JAK2 O60674 9/20 0.38
GPR119 Q8TDV5 4/20 0.36
ADAM10 O14672 5/20 0.34
MMP2 P08253 3/20 0.34
HRH3 Q9Y5N1 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33

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
SCHEMBL388446 1.00 JAK1 (0.38) JAK1JAK2GPR119ADAM10MMP2
SCHEMBL389720 1.00 JAK1 (0.38) JAK1JAK2GPR119ADAM10MMP2
SCHEMBL387151 0.95 JAK1 (0.36) JAK1JAK2GPR119HRH3
SCHEMBL389751 0.95 HRH3 (0.34) JAK1JAK2GPR119HRH3
SCHEMBL390073 0.91 HRH3 (0.36) GPR119HRH3
SCHEMBL389666 0.90 JAK2 (0.36) JAK1JAK2GPR119
SCHEMBL391229 0.89 HRH3 (0.35) HRH3
SCHEMBL386757 0.88 HRH3 (0.34) HRH3
SCHEMBL391834 0.87 HRH3 (0.34) HRH3
SCHEMBL388767 0.86 KCNH2 (0.40)

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
US-8101626-B2 GPR119 receptor agonists in methods of increasing bone mass and of treating osteoporosis and other conditions characterized by low bone mass, and combination therapy relating thereto ARENA PHARMACEUTICALS, INC. (US) 2012-01-24 US disclosed
EP-2004157-B1 USE OF GPR119 RECEPTOR AGONISTS FOR INCREASING BONE MASS AND FOR TREATING OSTEOPOROSIS, AS WELL AS COMBINATION THERAPY RELATING THERETO ARENA PHARM INC (US) 2011-01-12 EP disclosed