SCHEMBL8209997

SCHEMBL8209997

CC(=O)OC(C#N)C(CCCN(C(=O)OCc1ccccc1)C(N)=NC(=O)OCc1ccccc1)NC(=O)OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSL P07711 10/20 0.39
CTSS P25774 10/20 0.39
CTSB P07858 6/20 0.39
CTSK P43235 6/20 0.39
TACR1 P25103 1/20 0.38
KLK8 O60259 1/20 0.37
F2 P00734 1/20 0.37
PLG P00747 1/20 0.37
PLAU P00749 1/20 0.37
PLAT P00750 1/20 0.37
KLK1 P06870 1/20 0.37
KLK4 Q9Y5K2 1/20 0.37

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
SCHEMBL8203294 0.82 CTSL (0.44) CTSLKLK8F2PLGPLAU
SCHEMBL7355009 0.79 CTSL (0.51) CTSLCTSS
SCHEMBL29398620 0.79 CTSL (0.51) CTSLCTSS
SCHEMBL8216035 0.78 CTSL (0.49) CTSLCTSSCTSBCTSKTACR1
SCHEMBL989683 0.75 CCR6 (0.45) PLAU
SCHEMBL6827318 0.74 CTSL (0.39) CTSL
SCHEMBL13430765 0.73 MAPT (0.54) CTSLCTSSCTSB
SCHEMBL7359299 0.73 HTT (0.44) CTSL
SCHEMBL7355382 0.72 HTT (0.43) PLAU
SCHEMBL8039587 0.72 CCR6 (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5916888-A Imidazo 1,5A!pyridine derived serine protease inhibitors AKZO NOBEL, N.V. (NL) 1999-06-29 US claimed
EP-0830371-B1 IMIDAZO(1,5a]PYRIDINE DERIVED SERINE PROTEASE INHIBITORS AKZO NOBEL NV (NL) 2000-12-20 EP disclosed
US-5916888-A Imidazo 1,5A!pyridine derived serine protease inhibitors AKZO NOBEL, N.V. (NL) 1999-06-29 US disclosed
EP-0830371-A1 IMIDAZO 1,5a]PYRIDINE DERIVED SERINE PROTEASE INHIBITORS Akzo Nobel N.V. (NL) 1998-03-25 EP disclosed
WO-1996038470-A1 IMIDAZO[1,5a]PYRIDINE DERIVED SERINE PROTEASE INHIBITORS AKZO NOBEL N.V. (NL) 1996-12-05 WO disclosed