SCHEMBL19559844

SCHEMBL19559844

CC(C)C[C@@H](N)C(=O)NN

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.56
LARS1 Q9P2J5 3/20 0.46
ANPEP P15144 6/20 0.46
RNPEP Q9H4A4 2/20 0.46
DNPEP Q9ULA0 2/20 0.46
AAK1 Q2M2I8 2/20 0.44
SLC1A3 P43003 1/20 0.43
SLC1A2 P43004 1/20 0.43
HIF1A Q16665 1/20 0.40
LAP3 P28838 2/20 0.38
ERAP1 Q9NZ08 1/20 0.38
SCN9A Q15858 3/20 0.38
CIT O14578 1/20 0.38

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
SCHEMBL8330499 1.00 SLC7A5 (0.56) SLC7A5LARS1ANPEPRNPEPDNPEP
SCHEMBL4677717 1.00 SLC7A5 (0.56) SLC7A5LARS1ANPEPRNPEPDNPEP
Bromide SCHEMBL11107160 0.98 SLC7A5 (0.54) SLC7A5LARS1ANPEPRNPEPDNPEP
SCHEMBL2715188 0.81 SLC7A5 (0.56) SLC7A5LARS1ANPEPRNPEPDNPEP
SCHEMBL836565 0.81 SLC7A5 (0.56) SLC7A5LARS1ANPEPRNPEPDNPEP
SCHEMBL246046 0.81 SLC7A5 (0.56) SLC7A5LARS1ANPEPRNPEPDNPEP
SCHEMBL1174387 0.81 SLC7A5 (0.56) SLC7A5LARS1ANPEPRNPEPDNPEP
SCHEMBL2517387 0.81 SLC7A5 (0.56) SLC7A5LARS1ANPEPRNPEPDNPEP
SCHEMBL4318870 0.81 SLC7A5 (0.56) SLC7A5LARS1ANPEPRNPEPDNPEP
SCHEMBL10296149 0.79 SLC7A5 (0.54) SLC7A5LARS1ANPEPRNPEPDNPEP

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-3044204-B1 A PHOTOLABILE LINKER FOR THE SOLID-PHASE SYNTHESIS OF HYDRAZIDES AND PYRANOPYRAZOLES UNIV DANMARKS TEKNISKE (DK) 2017-11-08 EP disclosed