SCHEMBL6941754

SCHEMBL6941754

CC(N)C(F)CP(C)(=O)O

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 4/20 0.45
GABBR1 Q9UBS5 4/20 0.45
GABRR1 P24046 1/20 0.45
METAP1 P53582 1/20 0.38
LAP3 P28838 4/20 0.37
ANPEP P15144 3/20 0.37
ERAP1 Q9NZ08 1/20 0.37
ALDH1A1 P00352 2/20 0.34
FDPS P14324 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.33
THPO P40225 1/20 0.33

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
SCHEMBL1890961 0.71
SCHEMBL1884027 0.71
SCHEMBL1883346 0.71
SCHEMBL601258 0.69
SCHEMBL6938427 0.68 GABBR2 (0.45) GABBR2GABBR1GABRR1CYP1A2TSHR
SCHEMBL8762129 0.67
SCHEMBL14803215 0.65 GABBR2 (0.42) GABBR2GABBR1GABRR1METAP1LAP3
SCHEMBL19697646 0.65 PTGS1 (0.48) GABBR2GABBR1GABRR1
SCHEMBL13892954 0.65 PTGS1 (0.48) GABBR2GABBR1GABRR1
SCHEMBL23995837 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2003516346-A 2003-05-13 JP claimed
EP-1239843-A1 NEW (AMINOPROPYL)METHYLPHOSPHINIC ACIDS AstraZeneca AB (SE) 2002-09-18 EP claimed
WO-2001041743-A1 NEW (AMINOPROPYL)METHYLPHOSPHINIC ACIDS ASTRAZENECA AB (SE) 2001-06-14 WO claimed
WO-2004000856-A1 COMBINATION OF A REFLUX INHIBITOR AND AN IMIDAZOPYRIDINE FOR THE TREATMENT OF GERD ASTRAZENECA AB (SE) 2003-12-31 WO disclosed
WO-2002100870-A1 NEW NAPSYLATE SALTS II ASTRAZENECA AB (SE) 2002-12-19 WO disclosed
EP-1239843-A1 NEW (AMINOPROPYL)METHYLPHOSPHINIC ACIDS AstraZeneca AB (SE) 2002-09-18 EP disclosed
WO-2001041743-A1 NEW (AMINOPROPYL)METHYLPHOSPHINIC ACIDS ASTRAZENECA AB (SE) 2001-06-14 WO disclosed