SCHEMBL7449477

SCHEMBL7449477

CCC(CO)(CO)NC(=O)C(C)N

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC15A1 P46059 1/20 0.38
DPP4 P27487 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP7 Q9UHL4 1/20 0.35
PAX8 Q06710 1/20 0.34
HRH3 Q9Y5N1 1/20 0.30

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
SCHEMBL18347932 0.83 HRH3 (0.32) HRH3
SCHEMBL2314282 0.78
SCHEMBL12308878 0.78 SLC15A1 (0.34) SLC15A1DPP4DPP8DPP7
SCHEMBL5482221 0.74 HRH3 (0.33) HRH3
SCHEMBL25763081 0.73 HRH3 (0.35) HRH3
SCHEMBL221668 0.72 HRH3 (0.34) HRH3
SCHEMBL4578255 0.72 KDM4E (0.36) HRH3
SCHEMBL20624707 0.72 DUT (0.33)
SCHEMBL18622068 0.72 PKM (0.45) HRH3
SCHEMBL23097458 0.71 HRH3 (0.35) HRH3

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-1998054123-A1 SUBSTITUTED PEPTIDYLAMINE CALCIUM CHANNEL BLOCKERS WARNER-LAMBERT COMPANY (US) 1998-12-03 WO claimed