SCHEMBL7378154

SCHEMBL7378154

COC(=O)[C@@]1([C]=O)CCCN1C(=O)[C@H](N)CC1CCC1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
DPP4 P27487 1/20 0.32
CTSL P07711 1/20 0.31
CTSB P07858 1/20 0.31
CTSH P09668 1/20 0.31
CTSK P43235 1/20 0.31
HRH2 P25021 1/20 0.31
HRH1 P35367 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
SCHEMBL7374132 0.88 DPP4 (0.33) SLC1A3SLC1A2SLC1A1DPP4
SCHEMBL7412948 0.88 DPP4 (0.33) SLC1A3SLC1A2SLC1A1DPP4CTSL
SCHEMBL7383092 0.72 SLC1A3 (0.35) SLC1A3SLC1A2SLC1A1
SCHEMBL7372843 0.67 SLC1A3 (0.35) SLC1A3SLC1A2SLC1A1
SCHEMBL7382436 0.67 SLC1A3 (0.35) SLC1A3SLC1A2SLC1A1
SCHEMBL29052877 0.67 METAP2 (0.39) SLC1A3SLC1A2SLC1A1CTSK
SCHEMBL29052876 0.67 METAP2 (0.39) SLC1A3SLC1A2SLC1A1CTSK
SCHEMBL7414748 0.66 SLC1A3 (0.34) SLC1A3SLC1A2SLC1A1CTSLCTSB
SCHEMBL7372849 0.64 SLC1A3 (0.35) SLC1A3SLC1A2SLC1A1
SCHEMBL23849174 0.64 METAP2 (0.42) SLC1A3SLC1A2SLC1A1CTSLCTSB

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-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