SCHEMBL5052019

SCHEMBL5052019

Cc1c(Oc2ccc(CCS(N)(=O)=O)cc2F)ncnc1OC1CCNCC1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 16/20 0.47
CYP2C9 P11712 1/20 0.47
TRPA1 O75762 1/20 0.37
HTR1A P08908 2/20 0.37
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
IKBKB O14920 1/20 0.36
CHUK O15111 1/20 0.36
SLC6A3 Q01959 1/20 0.36

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
SCHEMBL27734766 0.84 GPR119 (0.55) GPR119CYP2C9TRPA1HTR1ASLC6A2
SCHEMBL1890890 0.82 GPR119 (0.66) GPR119CYP2C9
Hydrochloric Acid SCHEMBL1895317 0.82 GPR119 (0.65) GPR119CYP2C9
SCHEMBL390800 0.82 GPR119 (0.74) GPR119CYP2C9
SCHEMBL6066167 0.78 GPR119 (0.46) GPR119CYP2C9TRPA1HTR1ASLC6A2
SCHEMBL27734799 0.78 GPR119 (0.50) GPR119CYP2C9
SCHEMBL6066219 0.76 GPR119 (0.48) GPR119CYP2C9TRPA1HTR1ASLC6A2
SCHEMBL5051085 0.75 SLC6A2 (0.61) GPR119HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL27769004 0.74 GPR119 (0.42) GPR119CYP2C9TRPA1HTR1ASLC6A2
SCHEMBL27734806 0.74 GPR119 (0.44) GPR119CYP2C9HTR1ASLC6A2SLC6A4

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