SCHEMBL5046489

SCHEMBL5046489

CCOC(=O)C1CCN(c2ncnc(Nc3ccccc3F)c2[N+](=O)[O-])C(I)C1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 16/20 0.52
MAPT P10636 4/20 0.41
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL390133 0.87 GPR119 (0.68) GPR119MAPTALDH1A1KDM4EMEN1
SCHEMBL5261218 0.78 GPR119 (0.54) GPR119MAPTALDH1A1
SCHEMBL388662 0.76 GPR119 (0.67) GPR119MAPTALDH1A1KDM4ESMN1; SMN2
SCHEMBL6251383 0.76 GPR119 (0.50) GPR119MAPTALDH1A1MEN1KMT2A
SCHEMBL1673759 0.75 GPR119 (0.62) GPR119MAPTALDH1A1KDM4EMEN1
SCHEMBL1673858 0.73 GPR119 (0.81) GPR119MAPT
SCHEMBL12733784 0.73 GPR119 (0.83) GPR119MAPT
SCHEMBL389077 0.72 STAT3 (0.48) GPR119MAPTALDH1A1SMN1; SMN2
SCHEMBL5319508 0.72 PTPN11 (0.50) GPR119MAPTALDH1A1MEN1KMT2A
SCHEMBL388987 0.72 GPR119 (0.71) GPR119MAPTALDH1A1KDM4ESMN1; SMN2

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