SCHEMBL5264891

SCHEMBL5264891

CCOC(=O)OC1CCN(c2ncnc(Oc3ccc4oc(=O)ccc4c3)c2[N+](=O)[O-])CC1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.55
LGALS1 P09382 1/20 0.35
TSHR P16473 3/20 0.35
MAPT P10636 3/20 0.35
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
HSD17B10 Q99714 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.35
ALOX12 P18054 1/20 0.35
ACACB O00763 1/20 0.35
CA12 O43570 1/20 0.35
CA9 Q16790 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
SCHEMBL1673843 0.89 GPR119 (0.70) GPR119LGALS1TSHRMAPTALDH1A1
SCHEMBL5262910 0.85 GPR119 (0.54) GPR119TSHRMAPTALDH1A1KDM4E
SCHEMBL5264529 0.84 GPR119 (0.66) GPR119MAPTALDH1A1KDM4ESMN1; SMN2
SCHEMBL5260980 0.84 GPR119 (0.57) GPR119TSHRMAPTALDH1A1SMN1; SMN2
SCHEMBL5263099 0.83 GPR119 (0.65) GPR119TSHRMAPTALDH1A1KDM4E
SCHEMBL5263835 0.83 GPR119 (0.78) GPR119TSHRMAPTALDH1A1KDM4E
SCHEMBL5259999 0.82 GPR119 (0.69) GPR119MAPTALDH1A1ACACB
SCHEMBL5261101 0.82 GPR119 (0.68) GPR119MAPTALDH1A1SMN1; SMN2MAPK1
SCHEMBL5262168 0.82 GPR119 (0.64) GPR119MAPTALDH1A1SMN1; SMN2ACACB
SCHEMBL5264193 0.82 GPR119 (0.63) GPR119MAPTALDH1A1SMN1; SMN2ACACB

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