SCHEMBL5263665

SCHEMBL5263665

CCOC(=O)OC1CCN(c2ncnc(Oc3ccc(CC#N)cc3)c2[N+](=O)[O-])CC1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 11/20 0.60
MAPT P10636 4/20 0.41
GAA P10253 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ACACB O00763 4/20 0.37
LMNA P02545 1/20 0.37
ALDH1A1 P00352 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
SCHEMBL1673754 0.89 GPR119 (0.77) GPR119MAPTGAAL3MBTL1ALDH1A1
SCHEMBL5260174 0.89 GPR119 (0.67) GPR119MAPTACACBLMNAALDH1A1
SCHEMBL5264529 0.88 GPR119 (0.66) GPR119MAPTACACBLMNAALDH1A1
SCHEMBL5267143 0.88 GPR119 (0.59) GPR119MAPTACACBLMNA
SCHEMBL5263835 0.88 GPR119 (0.78) GPR119MAPTACACBLMNAALDH1A1
SCHEMBL5263099 0.88 GPR119 (0.65) GPR119MAPTACACBLMNAALDH1A1
SCHEMBL5263313 0.87 GPR119 (0.79) GPR119MAPTL3MBTL1ACACBLMNA
SCHEMBL5264549 0.87 GPR119 (0.67) GPR119MAPTGAAACACBLMNA
SCHEMBL5262168 0.87 GPR119 (0.64) GPR119MAPTACACBLMNAALDH1A1
SCHEMBL5259999 0.87 GPR119 (0.69) GPR119MAPTACACBLMNAALDH1A1

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
EP-1599468-B1 1,2,3-TRISUBSTITUTED ARYL AND HETEROARYL DERIVATIVES AS MODULATORS OF METABOLISM AND THE PROPHYLAXIS AND TREATMENT OF DISORDERS RELATED THERETO SUCH AS DIABETES AND HYPERGLYCEMIA ARENA PHARM INC (US) 2007-10-03 EP claimed