SCHEMBL9696799

SCHEMBL9696799

CC(C)(C)OC(=O)N1CCC[C@]1(C)OS(C)(=O)=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.39
GRIN2C Q14957 1/20 0.39
HPGD P15428 1/20 0.35
NR1H2 P55055 1/20 0.35
NR1H3 Q13133 1/20 0.35
USP2 O75604 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CTSK P43235 1/20 0.34
EPHX1 P07099 1/20 0.34
GPR119 Q8TDV5 5/20 0.34
JAK3 P52333 2/20 0.33
HSD17B10 Q99714 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
THRB P10828 1/20 0.32
RECQL P46063 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
SCHEMBL7014623 0.80
SCHEMBL6963400 0.80
SCHEMBL7014622 0.80
SCHEMBL28035994 0.79 GRIN2B (0.40) GRIN2BGRIN2CHPGDUSP2SMN1; SMN2
SCHEMBL15425361 0.77 GRIN2B (0.37) GRIN2BGRIN2CHPGDNR1H2NR1H3
SCHEMBL475482 0.76 GRIN2B (0.44) GRIN2BGRIN2CHPGDUSP2SMN1; SMN2
SCHEMBL932957 0.74 GRIN2B (0.43) GRIN2BGRIN2CHPGDUSP2SMN1; SMN2
SCHEMBL4730578 0.73 GRIN2B (0.42) GRIN2BGRIN2CHPGDUSP2SMN1; SMN2
SCHEMBL8528362 0.73 GRIN2B (0.45) GRIN2BGRIN2CHPGDNR1H2NR1H3
SCHEMBL28721452 0.73 GRIN2B (0.42) GRIN2BGRIN2CHPGDUSP2SMN1; SMN2

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-1992002521-A1 1-AZABICYCLO[3.2.0]HEPT-2-ENE-2-CARBOXYLIC ACID COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-02-20 WO disclosed