SCHEMBL24448586

SCHEMBL24448586

CC(C)CC(N)C(=O)N1CCC[C@H]1C=O

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 19/20 0.63
DPP7 Q9UHL4 14/20 0.63
DPP8 Q6V1X1 11/20 0.63
DPP9 Q86TI2 10/20 0.63
FAP Q12884 11/20 0.44
PREP P48147 3/20 0.41
XPNPEP1 Q9NQW7 1/20 0.41
PITRM1 Q5JRX3 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
SCHEMBL17760537 1.00 DPP4 (0.63) DPP4DPP7DPP8DPP9FAP
SCHEMBL16330589 0.84 DPP4 (0.44) DPP4DPP7DPP8DPP9FAP
SCHEMBL16670795 0.84 DPP4 (0.57) DPP4DPP7DPP8DPP9FAP
SCHEMBL15832763 0.83 DPP4 (0.48) DPP4DPP7DPP8DPP9FAP
SCHEMBL10057905 0.81 DPP4 (0.59) DPP4DPP7DPP8DPP9FAP
SCHEMBL2769142 0.81 DPP4 (0.59) DPP4DPP7DPP8DPP9FAP
SCHEMBL12001763 0.80 ACE (0.41) DPP4DPP7DPP8DPP9FAP
SCHEMBL18308997 0.79 DPP4 (0.41) DPP4DPP7DPP8DPP9XPNPEP1
SCHEMBL4409965 0.79 DPP4 (0.63) DPP4DPP7DPP8DPP9FAP
SCHEMBL10056816 0.79 DPP4 (0.63) DPP4DPP7DPP8DPP9FAP

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-4001272-A1 NMDA ANTAGONIST PRODRUGS Astrazeneca AB (SE) 2022-05-25 EP disclosed