SCHEMBL5052064

SCHEMBL5052064

CCCc1ccc(Nc2ncnc(OC3CCNCC3)c2C#N)cn1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.36
CHEK1 O14757 5/20 0.35
EGFR P00533 1/20 0.35
SGK1 O00141 1/20 0.33
TBK1 Q9UHD2 1/20 0.33
AXL P30530 1/20 0.33
TYRO3 Q06418 1/20 0.33
MERTK Q12866 1/20 0.33
IP6K1 Q92551 2/20 0.32
CYP11B2 P19099 2/20 0.32
CYP11B1 P15538 1/20 0.32

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
SCHEMBL1891618 0.85 GPR119 (0.40) GPR119EGFR
SCHEMBL5190095 0.83 GPR119 (0.37) GPR119CHEK1EGFRSGK1TBK1
SCHEMBL5189111 0.81 GPR119 (0.51) GPR119CHEK1EGFRSGK1CYP11B2
SCHEMBL389422 0.81 GPR119 (0.59) GPR119
SCHEMBL3164490 0.80 GPR119 (0.47) GPR119
SCHEMBL6065464 0.69 GPR119 (0.44) GPR119EGFR
SCHEMBL5048834 0.68 GPR119 (0.54) GPR119
SCHEMBL388757 0.68 GPR119 (0.58) GPR119
SCHEMBL5049657 0.66 GPR119 (0.42) GPR119EGFR
SCHEMBL1894615 0.66 GPR119 (0.62) GPR119

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