SCHEMBL8726969

SCHEMBL8726969

N[C@H](C(=O)N[C@H]([C]=O)C1CCCC1)C1CCCC1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GLS O94925 1/20 0.38
DPP4 P27487 17/20 0.38
EPHX1 P07099 2/20 0.37
DPP8 Q6V1X1 3/20 0.36
DPP9 Q86TI2 1/20 0.36
DPP7 Q9UHL4 4/20 0.36
KCNH2 Q12809 1/20 0.34

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
SCHEMBL8037074 0.98 GLS (0.38) GLSDPP4EPHX1DPP8DPP9
SCHEMBL7137545 0.98 GLS (0.38) GLSDPP4EPHX1DPP8DPP9
SCHEMBL7518096 0.76 DPP4 (0.40) DPP4EPHX1DPP8DPP9DPP7
SCHEMBL4041124 0.76 CA12 (0.37) EPHX1
SCHEMBL28208197 0.75 MMP2 (0.38) EPHX1
SCHEMBL14157321 0.75 MMP2 (0.38) EPHX1
SCHEMBL4044570 0.74 CA12 (0.40) EPHX1
SCHEMBL12154903 0.72 DPP4 (0.44) GLSDPP4EPHX1DPP8DPP9
SCHEMBL24900230 0.71 DPP4 (0.43) GLSDPP4EPHX1DPP8DPP9
SCHEMBL10213727 0.71 DPP4 (0.37) GLSDPP4EPHX1DPP7

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-5831002-A HYBRID POLYPEPTIDE BASF AKTIENGESELLSCHAFT (DE) 1998-11-03 US disclosed