SCHEMBL5260980

SCHEMBL5260980

CCOC(=O)OC1CCN(c2ncnc(Oc3ccc4c(c3)OCO4)c2[N+](=O)[O-])CC1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.57
CHRM2 P08172 1/20 0.38
MGLL Q99685 1/20 0.37
CHRM4 P08173 1/20 0.37
ALDH1A1 P00352 2/20 0.36
ACACB O00763 1/20 0.36
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL1673733 0.89 GPR119 (0.73) GPR119ALDH1A1MAPTTSHRSMN1; SMN2
SCHEMBL5264529 0.86 GPR119 (0.66) GPR119CHRM4ALDH1A1ACACBMAPT
SCHEMBL5263835 0.85 GPR119 (0.78) GPR119ALDH1A1ACACBMAPTLMNA
SCHEMBL5263099 0.85 GPR119 (0.65) GPR119ALDH1A1ACACBMAPTLMNA
SCHEMBL5262168 0.84 GPR119 (0.64) GPR119ALDH1A1ACACBMAPTLMNA
SCHEMBL5259999 0.84 GPR119 (0.69) GPR119ALDH1A1ACACBMAPTLMNA
SCHEMBL5261101 0.84 GPR119 (0.68) GPR119ALDH1A1ACACBMAPTLMNA
SCHEMBL5264891 0.84 GPR119 (0.55) GPR119ALDH1A1ACACBMAPTTSHR
SCHEMBL5264193 0.84 GPR119 (0.63) GPR119ALDH1A1ACACBMAPTLMNA
SCHEMBL5262377 0.84 GPR119 (0.63) GPR119ALDH1A1ACACBMAPTLMNA

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