SCHEMBL8260658

SCHEMBL8260658

CCOC(=O)c1cnc2nc(C)c(C(=O)OC(C)(C)C)c(-c3ccc(Cl)cc3Cl)n12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 9/20 0.47
DPP8 Q6V1X1 3/20 0.47
DPP9 Q86TI2 2/20 0.47
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
IDO1 P14902 1/20 0.43
MAPT P10636 4/20 0.41
KDM4E B2RXH2 1/20 0.41
EGFR P00533 1/20 0.38
KDR P35968 1/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
TSHR P16473 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CDC7 O00311 1/20 0.38
DBF4 Q9UBU7 1/20 0.38
GABRA2 P47869 1/20 0.36

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
SCHEMBL13604999 0.86 IDO1 (0.45) DPP4DPP8DPP9CNR1CNR2
SCHEMBL1408253 0.83 DPP4 (0.55) DPP4DPP8DPP9IDO1MAPT
SCHEMBL1408229 0.82 DPP4 (0.66) DPP4DPP8DPP9
SCHEMBL1408226 0.81 DPP4 (0.69) DPP4DPP8DPP9CNR1CNR2
SCHEMBL1407927 0.79 CNR1 (0.46) DPP4DPP8DPP9CNR1CNR2
SCHEMBL13605001 0.78 DPP4 (0.49) DPP4DPP8DPP9IDO1MAPT
SCHEMBL1408313 0.77 DPP4 (0.49) DPP4DPP8DPP9CNR1CNR2
SCHEMBL1408083 0.74 DPP4 (0.55) DPP4DPP8DPP9CNR1CNR2
SCHEMBL1407903 0.73 DPP4 (0.47) DPP4DPP8DPP9CNR1CNR2
SCHEMBL1408216 0.73 DPP4 (0.47) DPP4DPP8DPP9CNR1CNR2

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
WO-2006071752-A1 AZOLOPYRIMIDINE-BASED INHIBITORS OF DIPEPTIDYL PEPTIDASE IV AND METHODS BRISTOL-MYERS SQUIBB COMPANY (US) 2006-07-06 WO disclosed