SCHEMBL5263083

SCHEMBL5263083

CCOC(=O)OC1CCN(c2ncnc(N(C)c3ccccc3)c2[N+](=O)[O-])CC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.46
L3MBTL1 Q9Y468 1/20 0.43
MAPT P10636 4/20 0.42
ALDH1A1 P00352 3/20 0.42
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
POLB P06746 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL5259875 0.91 GPR119 (0.44) GPR119MAPTALDH1A1KDM4ESMN1; SMN2
SCHEMBL5260678 0.90 GPR119 (0.45) GPR119L3MBTL1MAPTALDH1A1KDM4E
SCHEMBL5261167 0.90 GPR119 (0.42) GPR119MAPTALDH1A1KDM4ESMN1; SMN2
SCHEMBL5262751 0.88 GPR119 (0.43) GPR119MAPTALDH1A1KDM4EMEN1
SCHEMBL1673629 0.88 GPR119 (0.59) GPR119MAPTALDH1A1RAB9AKDM4E
SCHEMBL1673801 0.79 GPR119 (0.58) GPR119MAPTALDH1A1RAB9AKDM4E
SCHEMBL5263259 0.78 GPR119 (0.61) GPR119MAPTALDH1A1MEN1KMT2A
SCHEMBL1673741 0.78 GPR119 (0.55) GPR119MAPTALDH1A1RAB9AKDM4E
SCHEMBL1673971 0.78 GPR119 (0.59) GPR119MAPTALDH1A1RAB9AKDM4E
SCHEMBL5259856 0.77 GPR119 (0.61) GPR119

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