SCHEMBL8205329

SCHEMBL8205329

C[C@H](NC(=O)[C@@H](Cc1ccccc1)N1C(=O)c2ccccc2C1=O)C(=O)O

nearest known ligand 0.81

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.68
GAA P10253 1/20 0.68
SDCBP O00560 4/20 0.67
SDC2 P34741 4/20 0.67
POLB P06746 2/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
TDP1 Q9NUW8 1/20 0.55
LTA4H P09960 2/20 0.54
AADAT Q8N5Z0 1/20 0.54
MME P08473 1/20 0.54

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
SCHEMBL8211172 0.89 ALDH1A1 (0.60) ALDH1A1GAASDCBPSDC2POLB
SCHEMBL7274235 0.83 ALDH1A1 (0.66) ALDH1A1GAAPOLBL3MBTL1MEN1
SCHEMBL11619526 0.82 ALDH1A1 (0.72) ALDH1A1GAAPOLBL3MBTL1MEN1
SCHEMBL3454947 0.82 ALDH1A1 (0.56) ALDH1A1GAASDCBPSDC2POLB
SCHEMBL4861809 0.81 ALDH1A1 (1.00) ALDH1A1GAAPOLBL3MBTL1MEN1
SCHEMBL392680 0.81 ALDH1A1 (1.00) ALDH1A1GAAPOLBL3MBTL1MEN1
SCHEMBL478614 0.81 ALDH1A1 (1.00) ALDH1A1GAAPOLBL3MBTL1MEN1
SCHEMBL30216480 0.81 ALDH1A1 (1.00) ALDH1A1GAAPOLBL3MBTL1MEN1
SCHEMBL7063991 0.81 SDCBP (0.49) ALDH1A1GAASDCBPSDC2POLB
SCHEMBL7063999 0.81 SDCBP (0.49) ALDH1A1GAASDCBPSDC2POLB

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-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