SCHEMBL4050169

SCHEMBL4050169

CC(C)OC(=O)N1CCC(N(C)Cc2cnc(-c3ccc(C(N)=O)cc3)cn2)CC1

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 19/20 0.57
ACACB O00763 1/20 0.38
ACACA Q13085 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
SCHEMBL13690516 0.91 GPR119 (0.60) GPR119
SCHEMBL13690504 0.91 GPR119 (0.53) GPR119
SCHEMBL13690401 0.89 GPR119 (0.48) GPR119
SCHEMBL13690499 0.87 GPR119 (0.57) GPR119
SCHEMBL4056589 0.87 ATR (0.40) GPR119ACACBACACA
SCHEMBL4048482 0.86 GPR119 (0.56) GPR119
SCHEMBL4057221 0.86 GPR119 (0.53) GPR119
SCHEMBL13690402 0.85 GPR119 (0.46) GPR119
SCHEMBL4373924 0.84 GPR119 (0.38) GPR119ACACBACACA
SCHEMBL4048254 0.84 GPR119 (0.46) 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
WO-2009106561-A1 PYRAZINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2009-09-03 WO disclosed
WO-2009106561-A1 PYRAZINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2009-09-03 WO disclosed