SCHEMBL8544723

SCHEMBL8544723

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

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.63
LAP3 P28838 1/20 0.63
SLC1A1 P43005 2/20 0.52
HCAR2 Q8TDS4 1/20 0.48
KDM4E B2RXH2 3/20 0.46
MAPT P10636 2/20 0.46
MAPK1 P28482 1/20 0.46
PPARG P37231 4/20 0.45
PPARA Q07869 3/20 0.45
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
GAA P10253 1/20 0.43
STAT1 P42224 1/20 0.43
RAB9A P51151 1/20 0.43
MMP1 P03956 1/20 0.42
MMP2 P08253 1/20 0.42
MMP9 P14780 1/20 0.42
MMP12 P39900 1/20 0.42

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
SCHEMBL3445511 0.86 LAP3 (0.81) LTA4HLAP3SLC1A1MAPK1CYP1A2
SCHEMBL6551873 0.86 LAP3 (0.81) LTA4HLAP3SLC1A1MAPK1CYP1A2
SCHEMBL8537520 0.86 LAP3 (0.81) LTA4HLAP3SLC1A1MAPK1CYP1A2
SCHEMBL15888143 0.85 SLC1A1 (0.56) SLC1A1HCAR2KDM4EMAPTMAPK1
Hydrochloric Acid SCHEMBL11089598 0.84 LAP3 (0.79) LTA4HLAP3SLC1A1MAPK1CYP1A2
Hydrochloric Acid SCHEMBL15876044 0.84 SLC1A1 (0.55) SLC1A1HCAR2KDM4EMAPTMAPK1
SCHEMBL748224 0.83 HCAR2 (0.52) SLC1A1HCAR2KDM4EMAPTMAPK1
SCHEMBL7959519 0.83 SLC1A1 (0.64) LAP3SLC1A1PPARGPPARA
SCHEMBL22885989 0.80 SLC1A1 (0.56) SLC1A1PPARGPPARAMAOBPARP10
SCHEMBL27284287 0.80 HCAR2 (0.51) SLC1A1HCAR2KDM4EMAPTMAPK1

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-0873308-A1 O-CARBAMOYL-PHENYLALANINOL COMPOUNDS, THEIR PHARMACEUTICALLY USEFUL SALTS AND PROCESS FOR PREPARING THE SAME SK Corporation (KR) 1998-10-28 EP disclosed
WO-1998015526-A1 O-CARBAMOYL-PHENYLALANINOL COMPOUNDS, THEIR PHARMACEUTICALLY USEFUL SALTS AND PROCESS FOR PREPARING THE SAME SK CORPORATION (KR) 1998-04-16 WO disclosed
EP-0820438-A1 O-CARBAMOYL-PHENYLALANINOL HAVING SUBSTITUENT AT BENZENE RING, ITS PHARMACEUTICALLY USEFUL SALTS AND METHOD FOR PREPARING THE SAME YUKONG LIMITED (KR) 1998-01-28 EP disclosed
WO-1996032375-A1 O-CARBAMOYL-PHENYLALANINOL HAVING SUBSTITUENT AT BENZENE RING, ITS PHARMACEUTICALLY USEFUL SALTS AND METHOD FOR PREPARING THE SAME YUKONG LIMITED (KR) 1996-10-17 WO disclosed