SCHEMBL7525607

SCHEMBL7525607

CC(C)OC(=O)OC(=O)[C@H](N)CC1CCC1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSK P43235 7/20 0.36
CTSL P07711 5/20 0.33
CTSB P07858 5/20 0.33
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
CTSH P09668 4/20 0.33
REN P00797 1/20 0.33
METAP2 P50579 1/20 0.32
ALOX5 P09917 1/20 0.32
ANPEP P15144 1/20 0.31

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
SCHEMBL7380225 0.85 METAP2 (0.37) CTSKSLC1A3SLC1A2SLC1A1REN
SCHEMBL7373721 0.85 METAP2 (0.37) CTSKSLC1A3SLC1A2SLC1A1REN
SCHEMBL7380602 0.83 SOAT1 (0.44) SLC1A3SLC1A2SLC1A1RENMETAP2
SCHEMBL7412455 0.83 SOAT1 (0.44) SLC1A3SLC1A2SLC1A1RENMETAP2
SCHEMBL7377846 0.83 SOAT1 (0.44) SLC1A3SLC1A2SLC1A1RENMETAP2
SCHEMBL7379023 0.79 SOAT1 (0.44) CTSKSLC1A3SLC1A2SLC1A1REN
SCHEMBL7381317 0.79 SOAT1 (0.44) CTSKSLC1A3SLC1A2SLC1A1REN
SCHEMBL2390908 0.77 CTSK (0.40) CTSKCTSLCTSBSLC1A3SLC1A2
SCHEMBL29052876 0.76 METAP2 (0.39) CTSKSLC1A3SLC1A2SLC1A1REN
SCHEMBL29052877 0.76 METAP2 (0.39) CTSKSLC1A3SLC1A2SLC1A1REN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0922054-B1 ANTICOAGULANT PEPTIDYL-ARGININE ALDEHYDE DERIVATIVES GYOGYSZERKUTATO INTEZET (HU) 2002-08-14 EP disclosed
US-6235707-B1 Anticoagulant peptidyl-arginine aldehyde derivatives GYOGYSZERKUTATO INTEZET KFT. (HU) 2001-05-22 US disclosed
EP-0922054-A1 ANTICOAGULANT PEPTIDYL-ARGININE ALDEHYDE DERIVATIVES GYOGYSZERKUTATO INTEZET KFT. (HU) 1999-06-16 EP disclosed
WO-1997046576-A1 ANTICOAGULANT PEPTIDYL-ARGININE ALDEHYDE DERIVATIVES Gyógyszerkutató Intézet Kft. (HU) 1997-12-11 WO disclosed