SCHEMBL13690754

SCHEMBL13690754

CC(C)(C)OC(=O)N1CCC(COc2cnc(-c3ccc(C(=O)N4CCC[C@H]4CO)cc3)cn2)CC1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.55
ALOX5AP P20292 2/20 0.44
FEN1 P39748 2/20 0.44
HDAC1 Q13547 1/20 0.43
CHEK2 O96017 1/20 0.42
ROCK2 O75116 1/20 0.41
SPHK2 Q9NRA0 2/20 0.40
SPHK1 Q9NYA1 1/20 0.40

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
SCHEMBL13690495 1.00 GPR119 (0.55) GPR119ALOX5APFEN1HDAC1CHEK2
SCHEMBL4049899 0.88 SPHK2 (0.44) GPR119ROCK2SPHK2SPHK1
SCHEMBL4048867 0.88 SPHK2 (0.44) GPR119ROCK2SPHK2SPHK1
SCHEMBL14191531 0.86 GPR119 (0.51) GPR119HDAC1CHEK2ROCK2
SCHEMBL13690526 0.85 GPR119 (0.48) GPR119HDAC1ROCK2
SCHEMBL13690346 0.85 GPR119 (0.48) GPR119HDAC1ROCK2
SCHEMBL13690475 0.84 GPR119 (0.59) GPR119ALOX5APFEN1HDAC1CHEK2
SCHEMBL13690462 0.84 GPR119 (0.57) GPR119ALOX5APFEN1HDAC1CHEK2
SCHEMBL13690558 0.83 GPR119 (0.58) GPR119ALOX5APFEN1HDAC1CHEK2
SCHEMBL13690457 0.83 GPR119 (0.56) GPR119ALOX5APFEN1HDAC1CHEK2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009106561-A1 PYRAZINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2009-09-03 WO disclosed