SCHEMBL7480565

SCHEMBL7480565

O=C(N[C@@H](Cc1cccc(F)c1)C(=O)O)OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR34 Q9UPC5 3/20 0.56
CTSB P07858 2/20 0.56
CTSS P25774 2/20 0.56
CTSK P43235 2/20 0.56
ITGB3 P05106 6/20 0.55
ITGAV P06756 1/20 0.55
ITGA2B P08514 5/20 0.55
TACR1 P25103 2/20 0.54
CTSL P07711 1/20 0.53
TYR P14679 1/20 0.53
ALDH1A1 P00352 1/20 0.52
ALOX15 P16050 1/20 0.52

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
SCHEMBL29972959 1.00 GPR34 (0.56) GPR34CTSBCTSSCTSKITGB3
SCHEMBL3303033 0.91 ITGB3 (0.56) GPR34CTSBCTSSCTSKITGB3
SCHEMBL25517362 0.89 PPARA (0.49) GPR34CTSBCTSSCTSKITGB3
SCHEMBL28951442 0.89 PPARA (0.49) GPR34CTSBCTSSCTSKITGB3
SCHEMBL30174969 0.89 PPARA (0.49) GPR34CTSBCTSSCTSKITGB3
SCHEMBL28951445 0.89 PPARA (0.49) GPR34CTSBCTSSCTSKITGB3
SCHEMBL5400377 0.87 GPR34 (0.76) GPR34ITGB3ITGA2B
SCHEMBL8258487 0.87 GPR34 (0.63) GPR34CTSBCTSSCTSKITGB3
SCHEMBL5288135 0.87 TYR (0.58) CTSBCTSSCTSKITGB3ITGAV
SCHEMBL7291131 0.87 GPR34 (0.63) GPR34CTSBCTSSCTSKITGB3

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-0950046-B1 3,4-DISUBSTITUTED AZETIDIN-2-ONE DERIVATIVES USEFUL AS CYSTEINE PROTEINASE REGULATORS NAEJA PHARMACEUTICAL INC (CA) 2002-04-10 EP disclosed
EP-0950046-A1 3,4-DISUBSTITUTED AZETIDIN-2-ONE DERIVATIVES USEFUL AS CYSTEINE PROTEINASE REGULATORS SYNPHAR LABORATORIES INC. (CA) 1999-10-20 EP disclosed
US-5959123-A REACATING SUBSTITUTED AMINO ACID WITH 3-AMINO-4-SUBSTITUTED-AZETIDINE-2-ONE COMPOUND TO FORM 3, 4-DISUBSTITUTED-AZETIDINE-2-ONE COMPOUND; USEFUL FOR TREATING MUSCULAR DYSTROPHY, ARTHRITIS, VIRAL AND PARASITIC INFECTIONS SYNPHAR LABORATORIES, INC. (CA) 1999-09-28 US disclosed
WO-1998012176-A1 3,4-DISUBSTITUTED AZETIDIN-2-ONE DERIVATIVES USEFUL AS CYSTEINE PROTEINASE REGULATORS SYNPHAR LABORATORIES INC. (US) 1998-03-26 WO disclosed