SCHEMBL5133256

SCHEMBL5133256

N#Cc1cc(-c2nc(COC3CCN(C(=O)O)CC3)no2)ccn1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 8/20 0.41
GPR119 Q8TDV5 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CPT2 P23786 3/20 0.37
CPT1A P50416 3/20 0.37
SPHK1 Q9NYA1 2/20 0.36
FFAR1 O14842 1/20 0.35
TBK1 Q9UHD2 1/20 0.35
KCNH2 Q12809 1/20 0.35
MCHR1 Q99705 1/20 0.35
CCR6 P51684 1/20 0.35
S1PR1 P21453 1/20 0.35
UCHL1 P09936 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
SCHEMBL391788 0.89 CETP (0.44) USP30GPR119CPT2CPT1AFFAR1
SCHEMBL389149 0.88 CETP (0.44) USP30GPR119CCR6
SCHEMBL386184 0.88 GPR119 (0.54) USP30GPR119TBK1
SCHEMBL28766879 0.85 GPR119 (0.39) USP30GPR119ALDH1A1SPHK1CCR6
SCHEMBL4521480 0.82 ALDH1A1 (0.43) USP30ALDH1A1KCNH2
SCHEMBL4655448 0.81 S1PR1 (0.53) TBK1S1PR1
SCHEMBL27657417 0.81 USP30 (0.38) USP30ALDH1A1CPT2CPT1ASPHK1
SCHEMBL1069804 0.80 GPR119 (0.33) GPR119ALDH1A1CPT2CPT1ATBK1
SCHEMBL14640963 0.79 ROCK2 (0.45) CPT2CPT1ATBK1S1PR1
SCHEMBL5134354 0.78 SCD (0.33) 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