SCHEMBL8444385

SCHEMBL8444385

CCOC(=O)[C@H]1C[C@@](N)(C(=O)OCC)C[C@H]1C(=O)OCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.37
GAA P10253 2/20 0.36
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALOX15 P16050 1/20 0.35
MGAM O43451 1/20 0.35
SI P14410 1/20 0.35
MGAM2 Q2M2H8 1/20 0.35
GRM4 Q14833 4/20 0.35
CYP2C19 P33261 3/20 0.35
CYP2D6 P10635 2/20 0.35
CYP2C9 P11712 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
GRM8 O00222 1/20 0.35
GRM6 O15303 1/20 0.35

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
SCHEMBL4589939 1.00 CYP1A2 (0.37) CYP1A2GAAMEN1ALDH1A1KMT2A
SCHEMBL8501127 1.00 CYP1A2 (0.37) CYP1A2GAAMEN1ALDH1A1KMT2A
SCHEMBL7497017 0.85 CYP3A4 (0.41) CYP1A2GAAALDH1A1KDM4EMAPT
SCHEMBL12343942 0.81 ALOX15 (0.38) CYP1A2GAAALDH1A1KDM4EHSD17B10
SCHEMBL20605561 0.81 ALOX15 (0.38) CYP1A2GAAALDH1A1KDM4EHSD17B10
SCHEMBL3141492 0.81 GAA (0.38) CYP1A2GAAALDH1A1KDM4EHSD17B10
Hydrochloric Acid SCHEMBL13276364 0.79 ALOX15 (0.37) CYP1A2GAAALDH1A1KDM4EHSD17B10
Hydrochloric Acid SCHEMBL2789388 0.79 ALOX15 (0.37) CYP1A2GAAALDH1A1KDM4EALOX15
SCHEMBL22945696 0.78 GAA (0.35) CYP1A2GAAALDH1A1KDM4EHSD17B10
SCHEMBL31462441 0.78 GAA (0.35) CYP1A2GAAALDH1A1KDM4EHSD17B10

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
WO-2008138621-A2 SYNTHESIS OF AMINOCYCLOPENTANE CARBOXYLIC ACIDS FAUST PHARMACEUTICALS (FR) 2008-11-20 WO disclosed
WO-2008138620-A2 1-AMINOCYCLOPENTANE-1,3,4-TRICARBOXYLIC ACIDS DERIVATIVES FAUST PHARMACEUTICALS (FR) 2008-11-20 WO disclosed
EP-1992637-A1 1-Aminocyclopentane-1,3,4- tricarboxylic acids derivatives Faust Pharmaceuticals (FR) 2008-11-19 EP disclosed
EP-1992610-A1 New route of synthesis Faust Pharmaceuticals (FR) 2008-11-19 EP disclosed