SCHEMBL7068128

SCHEMBL7068128

N=C(N)c1ccc(N2CC(COc3ccc4c(c3)OCO4)OC2=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.51
GRM2 Q14416 13/20 0.49

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
SCHEMBL7068542 0.90 GRM2 (0.50) SIGMAR1GRM2
SCHEMBL7386950 0.88 GRM2 (0.63) GRM2
SCHEMBL7386353 0.84 GRM2 (0.59) GRM2
SCHEMBL2823357 0.84 GRM2 (0.70) SIGMAR1GRM2
SCHEMBL7066394 0.84 SIGMAR1 (0.49) SIGMAR1GRM2
SCHEMBL7067302 0.84 GRM2 (0.57) GRM2
SCHEMBL7387162 0.84 GRM2 (0.59) GRM2
SCHEMBL7069257 0.83 GRM2 (0.61) GRM2
SCHEMBL8361132 0.83 GRM2 (0.58) GRM2
SCHEMBL8306311 0.83 GRM2 (0.50) GRM2

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
WO-2003047572-A1 USE OF 1-PHENYL-OXAZOLIDINE-2-ONE COMPOUNDS AS PROTEASE M INHIBITORS MERCK PATENT GMBH (DE) 2003-06-12 WO claimed
WO-2003047572-A1 USE OF 1-PHENYL-OXAZOLIDINE-2-ONE COMPOUNDS AS PROTEASE M INHIBITORS MERCK PATENT GMBH (DE) 2003-06-12 WO disclosed