SCHEMBL8815499

SCHEMBL8815499

CC(C)(C)C(=O)COC(=O)[C@@H]1CCCN1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.38
DPP8 Q6V1X1 4/20 0.38
DPP9 Q86TI2 4/20 0.38
DPP7 Q9UHL4 2/20 0.38
FAP Q12884 1/20 0.38
PRCP P42785 2/20 0.37
NOS2 P35228 2/20 0.34
NOS3 P29474 1/20 0.34
NOS1 P29475 1/20 0.34
MAPK1 P28482 1/20 0.34
HTR2C P28335 1/20 0.33
SCN4A P35499 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
SCHEMBL7096783 0.81 PRCP (0.40) DPP4DPP8DPP9DPP7FAP
SCHEMBL14761896 0.80 NOS2 (0.38) DPP4DPP8DPP9DPP7FAP
SCHEMBL9680371 0.79 DPP4 (0.37) DPP4DPP8DPP9DPP7FAP
SCHEMBL10519805 0.79 PRCP (0.41) DPP4DPP8DPP9DPP7FAP
SCHEMBL6876323 0.78 NOS2 (0.46) DPP4DPP8DPP9DPP7FAP
SCHEMBL3330660 0.78 PRCP (0.45) DPP4DPP8DPP9DPP7FAP
SCHEMBL10829027 0.78 PRCP (0.45) DPP4DPP8DPP9DPP7FAP
SCHEMBL133135 0.78 PRCP (0.45) DPP4DPP8DPP9DPP7FAP
SCHEMBL115996 0.78 PRCP (0.45) DPP4DPP8DPP9DPP7FAP
SCHEMBL18823540 0.77 DPP4 (0.38) DPP4DPP8DPP9DPP7FAP

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
US-5686424-A FOR TREATING INFLAMMATION MILES INC. (US) 1997-11-11 US disclosed