SCHEMBL5310871

SCHEMBL5310871

CC1COC(C)(C)OC1C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 8/20 0.33
HCRTR1 O43613 5/20 0.33
MAPK1 P28482 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TMEM97 Q5BJF2 2/20 0.33
SIGMAR1 Q99720 2/20 0.33
TBXA2R P21731 1/20 0.33
SUCNR1 Q9BXA5 1/20 0.32
CA2 P00918 2/20 0.32
TBXAS1 P24557 1/20 0.32
APLNR P35414 1/20 0.31

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
SCHEMBL16280834 1.00 HCRTR2 (0.33) HCRTR2HCRTR1MAPK1NPSR1TMEM97
SCHEMBL28331791 0.83 MAPK1 (0.31) MAPK1NPSR1
SCHEMBL18658770 0.76 HCRTR1 (0.31) HCRTR2HCRTR1MAPK1NPSR1TMEM97
SCHEMBL16153579 0.74 CA2 (0.43) HCRTR2HCRTR1MAPK1NPSR1TBXA2R
SCHEMBL2898462 0.74 CA2 (0.43) HCRTR2HCRTR1MAPK1NPSR1TBXA2R
SCHEMBL21302829 0.73 MAPK1 (0.33) HCRTR2HCRTR1MAPK1NPSR1CA2
SCHEMBL1595064 0.73 SUCNR1 (0.45) MAPK1NPSR1SUCNR1CA2APLNR
SCHEMBL1595065 0.73 SUCNR1 (0.45) MAPK1NPSR1SUCNR1CA2APLNR
SCHEMBL10473227 0.73 SUCNR1 (0.45) MAPK1NPSR1SUCNR1CA2APLNR
SCHEMBL27159744 0.73 SUCNR1 (0.45) MAPK1NPSR1SUCNR1CA2APLNR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007051252-A1 POROUS POLYMERIC MATERIALS AND POLYMER PARTICLES FOR PREPARATION THEREOF THE UNIVERSITY OF MELBOURNE (AU) 2007-05-10 WO disclosed