SCHEMBL25910102

SCHEMBL25910102

CC[C@@H](N)C(=O)N1CCN(C(C)C)CC1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 2/20 0.44
DPP4 P27487 8/20 0.41
DPP8 Q6V1X1 5/20 0.41
DPP9 Q86TI2 5/20 0.41
DPP7 Q9UHL4 3/20 0.41
FAP Q12884 1/20 0.41
HRH3 Q9Y5N1 6/20 0.40
KCNH2 Q12809 2/20 0.40
CYP2D6 P10635 1/20 0.40
HRH2 P25021 2/20 0.39
HRH1 P35367 2/20 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
SCHEMBL14148845 0.88
SCHEMBL23996277 0.84 DPP4 (0.44) CHRM1DPP4DPP8DPP9DPP7
SCHEMBL30484009 0.81 HTR1A (0.46) CHRM1DPP4DPP8DPP9DPP7
SCHEMBL18887809 0.81 EPHX2 (0.47) CHRM1HRH3KCNH2CYP2D6
SCHEMBL18195124 0.81 CYP2C19 (0.50) CHRM1HRH3KCNH2CYP2D6
SCHEMBL13300932 0.80 CHRM1 (0.45) CHRM1DPP4DPP8DPP9DPP7
SCHEMBL22253828 0.80 CHRM1 (0.45) CHRM1DPP4DPP8DPP9DPP7
SCHEMBL1706659 0.80 DPP7 (0.49) DPP4DPP8DPP9DPP7FAP
SCHEMBL1189924 0.80 DPP7 (0.49) DPP4DPP8DPP9DPP7FAP
SCHEMBL28132609 0.80 DPP7 (0.49) 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
WO-2023141300-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF KUMQUAT BIOSCIENCES INC. (US) 2023-07-27 WO disclosed