SCHEMBL2869805

SCHEMBL2869805

C[C@H]1CC(O)CC[C@H]1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 5/20 0.39
SLC1A2 P43004 2/20 0.34
SLC1A1 P43005 2/20 0.34
GRM2 Q14416 1/20 0.33
GABRR2 P28476 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
PPP5C P53041 1/20 0.32
ATM Q13315 1/20 0.32

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
SCHEMBL2869807 1.00 GABRR1 (0.39) GABRR1SLC1A2SLC1A1GRM2GABRR2
SCHEMBL20625191 1.00 GABRR1 (0.39) GABRR1SLC1A2SLC1A1GRM2GABRR2
SCHEMBL17803105 1.00 GABRR1 (0.39) GABRR1SLC1A2SLC1A1GRM2GABRR2
SCHEMBL7644053 0.84 GABRR1 (0.37) GABRR1SLC1A2SLC1A1GRM2GABRR2
SCHEMBL7635619 0.84 GABRR1 (0.37) GABRR1SLC1A2SLC1A1GRM2GABRR2
SCHEMBL19857354 0.84 GABRR1 (0.37) GABRR1SLC1A2SLC1A1GRM2GABRR2
SCHEMBL2865585 0.84 GABRR1 (0.37) GABRR1SLC1A2SLC1A1GRM2GABRR2
SCHEMBL2865583 0.84 GABRR1 (0.37) GABRR1SLC1A2SLC1A1GRM2GABRR2
SCHEMBL13503580 0.83 GABRR1 (0.40) GABRR1SLC1A2GRM2GABRR2PPP5C
SCHEMBL11905774 0.83 GABRR1 (0.40) GABRR1SLC1A2GRM2GABRR2PPP5C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7842361-B2 Oxygen-absorbing resin, oxygen-absorbing resin compositions and oxygen-absorbing containers TOYO SEIKAN KAISHA, LTD. (JP) 2010-11-30 US disclosed
US-20090098323-A1 OXYGEN-ABSORBING RESIN, OXYGEN-ABSORBING RESIN COMPOSITIONS AND OXYGEN-ABSORBING CONTAINERS TOYO SEIKAN KAISHA, LTD. (JP) 2009-04-16 US disclosed