SCHEMBL7297604

SCHEMBL7297604

N[C@@H](CCCCNC(=O)OCCc1ccccc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.55
CHRNB4 P30926 1/20 0.55
CHRNA3 P32297 1/20 0.55
CHRNA4 P43681 1/20 0.55
DPP8 Q6V1X1 3/20 0.55
DPP7 Q9UHL4 3/20 0.55
SLC1A3 P43003 1/20 0.53
SLC1A1 P43005 1/20 0.53
ANPEP P15144 1/20 0.53
DPP4 P27487 2/20 0.51
DPP9 Q86TI2 2/20 0.51
FOLH1 Q04609 3/20 0.48
LTA4H P09960 2/20 0.47
CTSK P43235 1/20 0.46
HDAC3 O15379 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46

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
SCHEMBL464672 0.87 DPP8 (0.69) DPP8DPP7SLC1A3SLC1A1ANPEP
SCHEMBL453671 0.87 DPP8 (0.69) DPP8DPP7SLC1A3SLC1A1ANPEP
SCHEMBL5816135 0.87 DPP8 (0.69) DPP8DPP7SLC1A3SLC1A1ANPEP
SCHEMBL25815858 0.86 TGM2 (0.46) CHRNB2CHRNB4CHRNA3CHRNA4DPP8
SCHEMBL22184125 0.86 TGM2 (0.46) CHRNB2CHRNB4CHRNA3CHRNA4DPP8
Hydrochloric Acid SCHEMBL7297967 0.86 DPP8 (0.68) DPP8DPP7SLC1A3SLC1A1ANPEP
SCHEMBL21219282 0.86 DPP8 (0.68) DPP8DPP7SLC1A3SLC1A1ANPEP
SCHEMBL7028548 0.86 DPP8 (0.68) DPP8DPP7SLC1A3SLC1A1ANPEP
SCHEMBL7025382 0.86 DPP8 (0.68) DPP8DPP7SLC1A3SLC1A1ANPEP
Hydrochloric Acid SCHEMBL18770783 0.86 DPP8 (0.68) DPP8DPP7SLC1A3SLC1A1ANPEP

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-0244836-A2 Tripeptide derivatives Dainippon Pharmaceutical Co., Ltd. (JP) 1987-11-11 EP disclosed