SCHEMBL5263259

SCHEMBL5263259

CCOC(=O)OC1CCN(c2ncnc(Oc3ccc(C(=O)c4ccccc4)cc3)c2[N+](=O)[O-])CC1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.61
MAPT P10636 5/20 0.40
POLB P06746 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
ALDH1A1 P00352 3/20 0.40
PDE10A Q9Y233 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
BTK Q06187 1/20 0.38
ACACB O00763 1/20 0.37

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
SCHEMBL5263448 0.93 GPR119 (0.61) GPR119MAPTPOLBALDH1A1PDE10A
SCHEMBL5263846 0.93 GPR119 (0.61) GPR119MAPTPOLBALDH1A1MEN1
SCHEMBL5264416 0.93 GPR119 (0.60) GPR119MAPTPOLBALDH1A1MEN1
SCHEMBL5262168 0.91 GPR119 (0.64) GPR119MAPTALDH1A1MEN1KMT2A
SCHEMBL5261101 0.91 GPR119 (0.68) GPR119MAPTALDH1A1MEN1KMT2A
SCHEMBL5264193 0.90 GPR119 (0.63) GPR119MAPTALDH1A1MEN1KMT2A
SCHEMBL5266142 0.89 GPR119 (0.60) GPR119MAPTALDH1A1MEN1KMT2A
SCHEMBL5264529 0.89 GPR119 (0.66) GPR119MAPTALDH1A1SMN1; SMN2ACACB
SCHEMBL1673779 0.88 GPR119 (0.78) GPR119MAPTPOLBALDH1A1MEN1
SCHEMBL5263099 0.88 GPR119 (0.65) GPR119MAPTPOLBALDH1A1SMN1; SMN2

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