SCHEMBL5264549

SCHEMBL5264549

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

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.67
MAPT P10636 4/20 0.41
ACACB O00763 6/20 0.37
LMNA P02545 1/20 0.37
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
POLB P06746 1/20 0.35
GAA P10253 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
SCHEMBL5260174 0.92 GPR119 (0.67) GPR119MAPTACACBLMNAALDH1A1
SCHEMBL5263313 0.90 GPR119 (0.79) GPR119MAPTACACBLMNAALDH1A1
SCHEMBL1673758 0.89 GPR119 (0.84) GPR119MAPTALDH1A1KDM4EPOLB
SCHEMBL5264529 0.88 GPR119 (0.66) GPR119MAPTACACBLMNAALDH1A1
SCHEMBL5262377 0.88 GPR119 (0.63) GPR119MAPTACACBLMNAALDH1A1
SCHEMBL5263099 0.88 GPR119 (0.65) GPR119MAPTACACBLMNAALDH1A1
SCHEMBL5263835 0.88 GPR119 (0.78) GPR119MAPTACACBLMNAALDH1A1
SCHEMBL5263665 0.87 GPR119 (0.60) GPR119MAPTACACBLMNAALDH1A1
SCHEMBL5262556 0.87 GPR119 (0.62) GPR119MAPTACACBLMNAPOLB
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