SCHEMBL31498019

SCHEMBL31498019

CCCC[C@H](C)[C@@H](C(=O)O)N1CC[C@@H](N)C1=O

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.48
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MAPT P10636 1/20 0.36
APEX1 P27695 1/20 0.36
ACE P12821 3/20 0.35
FAP Q12884 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
CA2 P00918 1/20 0.33
MAPK1 P28482 1/20 0.33
BCHE P06276 1/20 0.32
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32

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
SCHEMBL22636309 0.87 DPP4 (0.51) DPP4CYP3A4TSHRTDP1MAPT
SCHEMBL22636311 0.87 DPP4 (0.51) DPP4CYP3A4TSHRTDP1MAPT
SCHEMBL30405358 0.81 DPP4 (0.57) DPP4CYP3A4TSHRTDP1MAPT
SCHEMBL22128433 0.81 DPP4 (0.57) DPP4CYP3A4TSHRTDP1MAPT
SCHEMBL22122303 0.81 DPP4 (0.57) DPP4CYP3A4TSHRTDP1MAPT
SCHEMBL22122304 0.81 DPP4 (0.57) DPP4CYP3A4TSHRTDP1MAPT
SCHEMBL8724577 0.76 DPP4 (0.40) DPP4MAPTDPP8DPP9DPP7
SCHEMBL6560281 0.75 DPP4 (0.60) DPP4CYP3A4TSHRTDP1MAPT
SCHEMBL4495195 0.75 DPP4 (0.60) DPP4CYP3A4TSHRTDP1MAPT
SCHEMBL6560280 0.75 DPP4 (0.60) DPP4CYP3A4TSHRTDP1MAPT

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
CN-114585637-B MASP-inhibitory compounds and uses thereof 拜耳公司 2025-04-15 CN disclosed