SCHEMBL9572303

SCHEMBL9572303

CC(C)CC(CO)NC(=O)[C@@H](N)CC(C)C

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.47
ANPEP P15144 3/20 0.43
RNPEP Q9H4A4 2/20 0.43
DNPEP Q9ULA0 2/20 0.43
LARS1 Q9P2J5 3/20 0.41
SCN9A Q15858 3/20 0.40
AAK1 Q2M2I8 1/20 0.39
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
SLC1A3 P43003 1/20 0.37
SLC1A2 P43004 1/20 0.37
MME P08473 3/20 0.37
AURKA O14965 1/20 0.36
AURKB Q96GD4 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL19439391 0.92 ANPEP (0.42) SLC7A5ANPEPRNPEPDNPEPLARS1
SCHEMBL11116268 0.90 MME (0.46) SLC7A5LARS1SLC1A3SLC1A2MME
SCHEMBL8269796 0.89 SLC7A5 (0.44) SLC7A5ANPEPRNPEPDNPEPLARS1
SCHEMBL24759754 0.86 SLC7A5 (0.41) SLC7A5ANPEPRNPEPDNPEPLARS1
SCHEMBL24504314 0.84 ANPEP (0.41) SLC7A5ANPEPRNPEPDNPEPTAS1R3
SCHEMBL7330769 0.83 DPP7 (0.45) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL9572314 0.83 DPP7 (0.45) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL5455993 0.83 DPP4 (0.47) SLC7A5ANPEPRNPEPDNPEPTAS1R3
SCHEMBL27555287 0.83 DPP4 (0.47) SLC7A5ANPEPRNPEPDNPEPTAS1R3
SCHEMBL16327076 0.82 SLC7A5 (0.48) SLC7A5ANPEPRNPEPDNPEPLARS1

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-0543310-A2 Dipeptide derivative and prophylactic and therapeutic agent for bone diseases containing the same SUNTORY LIMITED (JP) 1993-05-26 EP disclosed