SCHEMBL8088907

SCHEMBL8088907

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

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.42
GRM5 P41594 1/20 0.42
GRM1 Q13255 1/20 0.42
GRM4 Q14833 5/20 0.35
GRM8 O00222 3/20 0.35
GRM6 O15303 2/20 0.35
THRB P10828 1/20 0.31
CYP2C9 P11712 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
SCHEMBL8088591 1.00 GRM2 (0.42) GRM2GRM5GRM1GRM4GRM8
SCHEMBL8088366 1.00 GRM2 (0.42) GRM2GRM5GRM1GRM4GRM8
SCHEMBL1954837 0.77
SCHEMBL2790345 0.77
SCHEMBL14647435 0.77
SCHEMBL3294258 0.77
SCHEMBL594504 0.77
SCHEMBL16240415 0.77
SCHEMBL8274144 0.77
SCHEMBL8245300 0.77

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-2009008913-A2 P1-NONEPIMERIZABLE KETOAMIDE INHIBITORS OF HCV NS3 PROTEASE SCHERING CORPORATION (US) 2009-01-15 WO disclosed