SCHEMBL21204651

SCHEMBL21204651

CCC(C)O[C@H]1CCN(C(C)=O)C1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 5/20 0.37
DPP8 Q6V1X1 3/20 0.37
DPP9 Q86TI2 2/20 0.37
DPP7 Q9UHL4 2/20 0.37
PIK3CD O00329 2/20 0.35
ACACB O00763 3/20 0.34
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL22473034 0.90 PIK3CD (0.41) DPP4DPP8DPP9DPP7PIK3CD
SCHEMBL21204571 0.89 PIK3CD (0.34) DPP4DPP8DPP9DPP7PIK3CD
SCHEMBL25094200 0.83 PDE4B (0.35) PIK3CD
SCHEMBL17660647 0.83 PDE4B (0.35) PIK3CD
SCHEMBL12448268 0.83 PDE4B (0.35) PIK3CD
SCHEMBL23315813 0.80 PIK3CD (0.39) PIK3CDMAPT
SCHEMBL20457873 0.79 DPP4 (0.32) DPP4PIK3CD
SCHEMBL19888520 0.78 PDE4B (0.37) PIK3CD
SCHEMBL12801554 0.76 VNN1 (0.41) PIK3CDGAAMAPT
SCHEMBL26352077 0.74 HPGD (0.48) DPP4MAPT

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-3517536-A1 AMINOTRIAZINE DERIVATIVES USEFUL AS TANK-BINDING KINASE INHIBITOR COMPOUNDS Gilead Sciences, Inc. (US) 2019-07-31 EP disclosed