SCHEMBL7141328

SCHEMBL7141328

NNC(=O)[AsH]CC1CCC(C(=O)O)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLG P00747 1/20 0.50
PLAT P00750 1/20 0.50
LMNA P02545 1/20 0.50
ANPEP P15144 1/20 0.41
ENPEP Q07075 1/20 0.41
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
CYP2C9 P11712 1/20 0.33
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32
GABRA1 P14867 1/20 0.32
TSHR P16473 1/20 0.32
GABRB1 P18505 1/20 0.32
GABRG2 P18507 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA5 P31644 1/20 0.32
GABRA3 P34903 1/20 0.32
GABRA2 P47869 1/20 0.32
GABRB2 P47870 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
Trifluoroacetic Acid SCHEMBL1127872 0.91 PLG (0.42) PLGPLATLMNAANPEPENPEP
SCHEMBL940065 0.69 PLG (0.52) PLGPLATLMNAANPEPENPEP
SCHEMBL7430073 0.69 PLG (0.52) PLGPLATLMNAANPEPENPEP
Tranexamic Acid SCHEMBL322487 0.68 PLG (1.00) PLGPLATLMNAANPEPENPEP
SCHEMBL21174845 0.68 PLG (0.60) PLGPLATLMNAANPEPENPEP
SCHEMBL25339676 0.68 PLG (0.60) PLGPLATLMNAANPEPENPEP
SCHEMBL21174844 0.68 PLG (0.60) PLGPLATLMNAANPEPENPEP
SCHEMBL13044796 0.68 PLG (0.60) PLGPLATLMNAANPEPENPEP
Tranexamic Acid SCHEMBL186034 0.68 PLG (1.00) PLGPLATLMNAANPEPENPEP
SCHEMBL29078888 0.68 LMNA (0.48) PLGPLATLMNAANPEPENPEP

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1358174-A2 INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES Amura Therapeutics Limited (GB) 2003-11-05 EP disclosed
WO-2002057248-A2 INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES AMURA THERAPEUTICS LIMITED (GB) 2002-07-25 WO disclosed